data_1mwz_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 1mwz _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 3.5299999999999998 107.123 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.592 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 3.1899999999999999 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 2.7999999999999998 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.592 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.63 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 2.5099999999999998 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.75 113.224 -161.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 2.5899999999999999 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.4099999999999999 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 3.23 111.152 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.4099999999999999 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68000000000000005 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 1.49 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 1.4399999999999999 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56000000000000005 108.087 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 1.48 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 6.7400000000000002 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 3.7999999999999998 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 1.9299999999999999 108.247 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.0600000000000001 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.71 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 1.8 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 2.9900000000000002 109.865 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 4.96 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.21 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 1.76 112.092 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 1.78 110.641 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.39000000000000001 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 1.7 111.979 -175.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.4099999999999999 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 2.73 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 3.5099999999999998 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.8799999999999999 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 2.8399999999999999 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 1.8500000000000001 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 3.3599999999999999 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 1.6100000000000001 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 1.9399999999999999 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.0999999999999996 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 1.9399999999999999 106.792 170.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 1.6000000000000001 105.168 174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 1.6699999999999999 107.635 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.8200000000000001 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 1.6499999999999999 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.5299999999999998 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 3.54 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.0499999999999998 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 1.72 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 8.8699999999999992 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 1.55 111.792 173.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.2200000000000002 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.476 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 1.6599999999999999 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.6699999999999999 108.451 -167.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 2.3100000000000001 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 1.5700000000000001 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 1.71 110.965 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.8500000000000001 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 3.8700000000000001 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 1.7 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.58999999999999997 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 3.23 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.8199999999999998 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 2.8999999999999999 110.999 168.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 4.0599999999999996 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.3999999999999999 110.622 170.816 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? . . . . . 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 4.54 106.052 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 3.3900000000000001 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 2.7999999999999998 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.38 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 2.5 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 3.0 110.128 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.8199999999999998 105.533 169.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.9100000000000001 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.0800000000000001 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 2.0600000000000001 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 2.1600000000000001 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 1.54 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.0700000000000001 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 1.6799999999999999 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 5.2999999999999998 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.9900000000000002 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 1.76 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.8300000000000001 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 3.6400000000000001 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 1.48 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 3.3300000000000001 111.016 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.96 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.3200000000000001 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 2.2000000000000002 111.836 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 2.0499999999999998 109.722 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.60999999999999999 113.477 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 1.74 111.802 -169.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.4199999999999999 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 2.6400000000000001 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 3.7799999999999998 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 2.8100000000000001 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 3.0299999999999998 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 4.9800000000000004 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 2.8199999999999998 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.9500000000000002 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.1799999999999997 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.96 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 2.3199999999999998 106.644 176.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 1.52 105.288 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 1.95 107.236 176.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.4300000000000002 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 1.72 112.086 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.4900000000000002 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 4.75 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.8500000000000001 111.05 166.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 1.6599999999999999 112.181 -174.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 3.02 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 1.78 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.5699999999999998 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 1.6200000000000001 108.772 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.51 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 1.6000000000000001 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 1.6100000000000001 111.012 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.8999999999999999 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.7200000000000002 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 1.8500000000000001 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89000000000000001 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 3.2999999999999998 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 2.1400000000000001 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 3.23 111.889 -178.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.9700000000000002 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.8300000000000001 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? . . . . . 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 3.71 109.163 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.512 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 3.21 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 2.3500000000000001 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.512 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.58999999999999997 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 2.8500000000000001 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 3.8500000000000001 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.75 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.2200000000000002 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 3.1899999999999999 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.3899999999999999 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.69999999999999996 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 1.5900000000000001 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 1.4199999999999999 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.46000000000000002 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 1.3600000000000001 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.9700000000000002 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 4.8799999999999999 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 1.7 109.946 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.1099999999999999 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.8700000000000001 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 1.79 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 2.8799999999999999 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 2.25 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.85999999999999999 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 1.6399999999999999 112.013 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 1.3799999999999999 109.737 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45000000000000001 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 1.51 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 1.2 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 3.6899999999999999 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 3.2200000000000002 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.9199999999999999 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 2.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 1.6899999999999999 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 3.3500000000000001 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 1.6399999999999999 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 1.8300000000000001 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.1200000000000001 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 3.6600000000000001 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 1.9199999999999999 107.503 176.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 1.6299999999999999 106.233 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 1.71 107.397 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.1400000000000001 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 1.54 109.058 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.6400000000000001 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 4.9900000000000002 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.4399999999999999 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 1.6799999999999999 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 3.2599999999999998 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 1.53 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.8900000000000001 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 1.6000000000000001 109.616 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.4199999999999999 108.691 -169.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 2.8900000000000001 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 1.5 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 1.78 110.737 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.3099999999999996 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 5.2400000000000002 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 1.6399999999999999 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 3.3300000000000001 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 2.6299999999999999 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 3.1299999999999999 111.401 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 4.1100000000000003 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.3899999999999997 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 3.2999999999999998 107.452 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.553 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 3.3399999999999999 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 2.96 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.553 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.48999999999999999 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 3.25 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 3.5499999999999998 111.135 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.7200000000000002 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.0499999999999998 105.306 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.96 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.68999999999999995 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 1.54 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 1.6100000000000001 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.46999999999999997 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 1.5600000000000001 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 6.0099999999999998 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 3.5 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 1.76 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.8300000000000001 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.6600000000000001 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 1.76 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.412 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 3.2599999999999998 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 2.5499999999999998 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.1299999999999999 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 1.73 110.938 -171.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 1.95 109.143 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.57999999999999996 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 1.7 112.045 -172.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 1.27 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 2.71 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 3.6800000000000002 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.6299999999999999 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 2.79 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 1.8400000000000001 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 3.1499999999999999 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 1.7 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 2.0099999999999998 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.5299999999999998 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 4.29 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 1.8700000000000001 104.894 172.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 1.76 105.313 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 1.9399999999999999 107.633 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.6600000000000001 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 1.51 110.494 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.4100000000000001 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 5.0300000000000002 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.0299999999999998 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 1.6100000000000001 112.722 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 3.3300000000000001 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 1.8600000000000001 111.176 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.8599999999999999 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.416 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 1.75 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.4100000000000001 110.233 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.51 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 1.6499999999999999 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.412 ' CD1' HG23 ' A' ' 26' ' ' VAL . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 1.73 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.8200000000000001 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 3.5699999999999998 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 1.5700000000000001 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.57999999999999996 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 3.4300000000000002 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 2.46 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 3.0099999999999998 113.02 -175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 4.3799999999999999 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.6099999999999999 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7000000000000002 109.622 164.288 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 4.4699999999999998 107.624 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.506 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 3.7599999999999998 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 2.3700000000000001 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.506 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.59999999999999998 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 3.96 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 3.75 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 2.73 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.4099999999999999 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 3.1099999999999999 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.1899999999999999 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.70999999999999996 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 1.8500000000000001 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 1.6200000000000001 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.48999999999999999 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 1.52 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 4.4699999999999998 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 4.0 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 1.6100000000000001 109.345 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.6699999999999999 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.1099999999999999 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 1.6000000000000001 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 3.3900000000000001 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.6600000000000001 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.83999999999999997 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 1.71 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 1.8200000000000001 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.34000000000000002 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 1.77 112.061 -169.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 1.23 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 3.0299999999999998 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 3.2999999999999998 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.8700000000000001 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 2.5600000000000001 106.58 171.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 1.8700000000000001 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 3.23 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 1.6899999999999999 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 1.8899999999999999 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.4699999999999998 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 4.4299999999999997 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 1.96 104.312 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 1.75 103.189 -176.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 1.9399999999999999 107.398 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 1.5900000000000001 111.023 -172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.3700000000000001 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 3.6000000000000001 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.3500000000000001 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 1.6200000000000001 111.382 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.8799999999999999 109.771 -164.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 1.5900000000000001 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.6800000000000002 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 1.6399999999999999 109.116 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.55 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 1.5600000000000001 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 1.8999999999999999 110.423 174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.8400000000000001 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 3.52 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 1.5 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54000000000000004 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 3.3799999999999999 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 2.2400000000000002 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 3.46 114.132 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 5.0199999999999996 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.8100000000000001 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.4100000000000001 108.14 162.363 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 3.75 106.268 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.538 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 3.2599999999999998 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 2.5899999999999999 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.538 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.58999999999999997 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 5.3200000000000003 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 2.8999999999999999 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 3.48 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.8500000000000001 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.269 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.269 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 1.52 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 1.3899999999999999 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45000000000000001 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 1.1399999999999999 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.9900000000000002 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 3.0899999999999999 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 1.9399999999999999 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.3599999999999999 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6000000000000001 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 1.5600000000000001 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 3.27 111.112 170.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 2.3799999999999999 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.21 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 1.6899999999999999 111.45 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 1.46 110.382 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.40000000000000002 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 1.6200000000000001 112.286 -173.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.6100000000000001 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 2.77 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 3.48 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.6299999999999999 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 4.0300000000000002 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 1.98 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 3.3300000000000001 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 1.52 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 2.2999999999999998 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.0199999999999996 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 3.6899999999999999 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 2.02 104.448 -176.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 1.6399999999999999 104.61 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 2.0 107.246 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.3999999999999999 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 1.6200000000000001 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.3399999999999999 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 3.48 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.1600000000000001 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 1.74 111.729 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.9399999999999999 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 1.49 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.9199999999999999 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 1.7 109.932 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1000000000000001 109.544 -172.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 1.49 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 1.71 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 1.75 110.365 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.8500000000000001 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 3.7000000000000002 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 1.4199999999999999 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46000000000000002 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 3.25 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 2.1400000000000001 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 2.6299999999999999 112.6 176.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.9500000000000002 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.7999999999999998 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.3399999999999999 110.217 177.693 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 3.9700000000000002 105.172 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 3.3300000000000001 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 2.6299999999999999 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.553 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.60999999999999999 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 2.3100000000000001 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.5099999999999998 112.542 -163.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.7799999999999998 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.9700000000000002 112.299 -170.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 1.6299999999999999 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 1.77 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 1.3200000000000001 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 4.1399999999999997 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 3.1099999999999999 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 1.76 108.684 175.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.8999999999999999 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 1.7 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 3.2599999999999998 111.434 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.6400000000000001 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.96999999999999997 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 1.5900000000000001 111.548 -172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 1.51 111.175 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.44 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 1.6200000000000001 111.319 -175.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.75 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 3.2799999999999998 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 3.29 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.4900000000000002 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 2.4700000000000002 109.302 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 1.6799999999999999 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 3.2000000000000002 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 1.77 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.6299999999999999 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.6400000000000001 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 3.0699999999999998 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 1.6599999999999999 105.123 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 1.8600000000000001 106.499 173.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 1.9299999999999999 108.457 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.71 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.5600000000000001 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 3.7000000000000002 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.8700000000000001 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 1.77 111.298 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 4.1500000000000004 111.775 -176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 1.6299999999999999 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1000000000000001 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.517 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 1.5900000000000001 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.4300000000000002 110.482 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 1.4399999999999999 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 1.6299999999999999 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 1.6899999999999999 110.212 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.8899999999999999 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.7599999999999998 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 1.47 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 3.2799999999999998 110.942 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 3.2599999999999998 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 2.73 113.609 174.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.98 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.5699999999999998 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.3599999999999999 110.2 171.702 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 3.3500000000000001 107.457 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 3.2200000000000002 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 2.5800000000000001 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.53000000000000003 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 2.71 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.6899999999999999 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.6899999999999999 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.3600000000000001 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 3.1899999999999999 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.60999999999999999 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 1.74 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 1.72 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.48999999999999999 109.046 172.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 1.27 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 5.1699999999999999 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 3.1099999999999999 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 1.8100000000000001 109.838 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.8500000000000001 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 3.6699999999999999 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 1.73 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 3.5299999999999998 110.679 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 2.5299999999999998 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 1.03 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 2.4700000000000002 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 1.98 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.56999999999999995 113.269 -170.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 1.5700000000000001 110.841 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 1.22 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 3.25 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 3.2599999999999998 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.6200000000000001 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 2.5800000000000001 106.412 173.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 1.6899999999999999 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 3.3100000000000001 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 1.5600000000000001 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 1.8200000000000001 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.6099999999999999 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 3.8399999999999999 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 2.0699999999999998 105.429 175.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 1.71 103.065 -178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 2.1600000000000001 107.292 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.1200000000000001 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 1.52 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 4.6399999999999997 104.312 -170.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 1.8200000000000001 113.932 -177.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 3.21 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 1.6799999999999999 111.011 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.2400000000000002 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 1.9099999999999999 108.582 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 2.0800000000000001 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 1.6399999999999999 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 1.73 110.633 176.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.8500000000000001 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 3.46 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 1.72 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.42999999999999999 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 3.3399999999999999 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 3.21 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 2.8100000000000001 113.563 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 4.0899999999999999 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.7200000000000002 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 4.46 107.607 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 3.5699999999999998 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 2.6000000000000001 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.68999999999999995 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 3.75 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 3.8700000000000001 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.7000000000000002 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.4299999999999999 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.71 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.257 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.5900000000000001 113.649 -174.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.257 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.77000000000000002 108.96 -168.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 1.6299999999999999 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 1.6399999999999999 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56000000000000005 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 1.8999999999999999 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 5.0099999999999998 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 3.4399999999999999 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 1.6899999999999999 110.277 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.8600000000000001 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 3.1400000000000001 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 1.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 2.7000000000000002 111.201 176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 5.29 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 1.1299999999999999 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 1.8100000000000001 112.103 -174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 1.5 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.45000000000000001 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 1.8500000000000001 110.909 -173.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.51 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 3.48 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 3.27 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.4300000000000002 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 2.5899999999999999 107.706 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 1.6200000000000001 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 3.5499999999999998 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 1.5600000000000001 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.8999999999999999 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.5700000000000003 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 3.8700000000000001 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 1.8600000000000001 105.07 177.688 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 1.5800000000000001 104.551 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 2.25 105.204 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.6200000000000001 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.6200000000000001 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 3.5 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.2999999999999998 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 1.71 111.699 -176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 3.6000000000000001 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 1.49 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.0800000000000001 110.592 174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 1.78 109.394 175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.9399999999999999 110.509 -174.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 1.3400000000000001 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 1.7 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 1.8899999999999999 111.207 175.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.8899999999999999 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 4.5700000000000003 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 1.8799999999999999 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.46999999999999997 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 3.4900000000000002 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 3.0800000000000001 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 3.4399999999999999 111.457 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 4.2599999999999998 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.1200000000000001 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.0199999999999996 109.032 164.675 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 3.2799999999999998 106.901 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 3.25 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 2.75 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.62 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 3.54 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 2.8599999999999999 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.7999999999999998 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.3600000000000001 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 3.0499999999999998 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.70999999999999996 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 1.5600000000000001 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 1.4199999999999999 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45000000000000001 108.695 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 1.6200000000000001 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 4.1200000000000001 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 4.1100000000000003 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 1.72 108.906 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.1200000000000001 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.8999999999999999 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 1.54 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 2.7799999999999998 111.242 170.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 2.4199999999999999 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.4199999999999999 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 1.6899999999999999 112.606 -169.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 1.8899999999999999 111.011 -176.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.44 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 1.6899999999999999 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.51 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 3.48 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 3.1000000000000001 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.2599999999999998 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 2.6499999999999999 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 1.71 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 3.3599999999999999 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 1.6399999999999999 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.98 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.4699999999999998 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 3.4900000000000002 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 1.8999999999999999 105.734 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 1.8500000000000001 105.324 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 2.1000000000000001 106.05 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.9199999999999999 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 1.4199999999999999 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.7400000000000002 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 3.5499999999999998 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.4300000000000002 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 1.5900000000000001 110.773 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 3.3300000000000001 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 1.75 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.4100000000000001 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.477 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 1.6200000000000001 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.8100000000000001 109.915 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.5 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 1.6599999999999999 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 2.04 110.643 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.8799999999999999 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 3.6400000000000001 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 1.8899999999999999 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.59999999999999998 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 3.2799999999999998 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 2.0600000000000001 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 2.6400000000000001 112.876 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 4.0899999999999999 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.432 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.1899999999999999 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.8599999999999999 109.34 161.756 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 3.5899999999999999 106.854 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 3.3700000000000001 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 2.3599999999999999 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.68000000000000005 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 3.4300000000000002 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.6299999999999999 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 2.5099999999999998 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.4299999999999999 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 3.6499999999999999 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.59999999999999998 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 1.48 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 1.6100000000000001 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45000000000000001 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 1.27 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 4.2699999999999996 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 3.4500000000000002 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 1.72 109.862 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.2599999999999998 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.7599999999999998 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 1.8799999999999999 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 2.75 110.333 171.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 2.2999999999999998 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 1.02 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 1.6399999999999999 111.966 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 1.74 110.569 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.38 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 1.54 111.467 -172.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.4399999999999999 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 3.0099999999999998 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 3.21 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.6099999999999999 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 2.6600000000000001 108.526 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 1.5700000000000001 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 3.1600000000000001 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 1.5800000000000001 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 1.9099999999999999 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.1200000000000001 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 3.0899999999999999 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 2.0 107.01 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 1.7 106.842 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 2.1400000000000001 105.769 -173.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 1.46 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 3.4900000000000002 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.3500000000000001 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 1.6799999999999999 112.985 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.6000000000000001 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 1.74 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.3799999999999999 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 1.6899999999999999 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.2400000000000002 109.654 -171.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 1.5800000000000001 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 1.6799999999999999 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 1.71 109.404 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 5.8200000000000003 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 3.5499999999999998 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 1.79 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54000000000000004 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 3.1600000000000001 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.7400000000000002 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 2.8300000000000001 111.239 168.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 6.6299999999999999 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.4500000000000002 107.859 172.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 3.9100000000000001 106.887 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 3.6699999999999999 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 2.4199999999999999 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.52 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.45000000000000001 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 2.6699999999999999 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.5600000000000001 112.917 -166.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.8599999999999999 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.5600000000000001 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 3.8300000000000001 112.936 -175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.4099999999999999 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82999999999999996 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 2.0 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 1.73 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.71999999999999997 108.655 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 1.6299999999999999 111.643 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 5.21 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.9700000000000002 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 1.7 108.566 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.3599999999999999 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.0800000000000001 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 1.77 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 2.9100000000000001 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 3.04 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.95999999999999996 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 1.73 112.571 -172.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 1.46 111.308 -176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 1.79 111.371 -173.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 1.1499999999999999 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 2.6499999999999999 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 3.4500000000000002 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.8700000000000001 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 3.5800000000000001 108.177 176.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 1.96 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 3.3999999999999999 110.502 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 1.72 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 2.1899999999999999 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.4900000000000002 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 3.2200000000000002 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 2.21 106.229 174.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 1.6100000000000001 104.867 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 2.1200000000000001 106.403 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.4500000000000002 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 1.6799999999999999 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.6400000000000001 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 3.5600000000000001 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 1.6599999999999999 112.675 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 3.3900000000000001 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 1.9399999999999999 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.1499999999999999 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.44 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 1.6000000000000001 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.0099999999999998 110.073 -174.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 1.76 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 1.53 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 1.8400000000000001 110.635 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.8600000000000001 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.9399999999999999 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 1.47 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52000000000000002 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 3.1499999999999999 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.9199999999999999 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 2.8999999999999999 113.246 172.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 4.6900000000000004 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.2300000000000004 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 3.6099999999999999 106.934 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.517 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 3.5 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.517 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.44 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 2.4100000000000001 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.6000000000000001 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 2.6200000000000001 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.3400000000000001 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.9399999999999999 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.57999999999999996 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 1.52 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 1.6499999999999999 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51000000000000001 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 1.46 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 4.8600000000000003 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 3.3199999999999998 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 1.9199999999999999 109.649 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.0600000000000001 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.0299999999999998 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 1.8100000000000001 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 3.1699999999999999 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.71 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 1.1299999999999999 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 1.74 112.045 -170.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 1.4399999999999999 110.721 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.42999999999999999 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 1.6599999999999999 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.24 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 2.9199999999999999 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 3.04 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.1499999999999999 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 2.7200000000000002 108.586 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 1.77 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 3.3799999999999999 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 1.5600000000000001 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 1.97 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.1100000000000003 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.8500000000000001 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 2.2999999999999998 106.008 173.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 1.6699999999999999 106.626 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 2.0 107.356 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.1200000000000001 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 1.4299999999999999 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.2200000000000002 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 40.0 t30 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 3.3300000000000001 102.759 172.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.44 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 1.6499999999999999 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 3.3799999999999999 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 2.04 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 1.6599999999999999 109.841 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.0899999999999999 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.3899999999999999 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 1.6599999999999999 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 1.79 110.183 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.9099999999999999 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 3.6299999999999999 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 1.6799999999999999 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.48999999999999999 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 3.2799999999999998 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 2.3500000000000001 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 3.48 112.567 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.9900000000000002 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.1100000000000003 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 . . . . . 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.3900000000000001 108.542 167.907 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 4.8499999999999996 106.314 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 3.4100000000000001 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 2.6600000000000001 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.76000000000000001 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 2.21 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 3.2599999999999998 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 2.29 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 6.46 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.68000000000000005 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 1.6000000000000001 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 1.9099999999999999 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66000000000000003 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 1.3400000000000001 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.9500000000000002 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 3.3999999999999999 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 2.2200000000000002 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.0699999999999998 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.7599999999999998 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 1.6599999999999999 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 2.9300000000000002 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 2.3900000000000001 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.1599999999999999 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 1.95 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 1.8400000000000001 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.48999999999999999 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 1.8999999999999999 110.98 -173.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 1.1200000000000001 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 3.5 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 2.9100000000000001 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 3.6400000000000001 108.118 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 1.5900000000000001 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 3.1600000000000001 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 1.6100000000000001 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 3.3799999999999999 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.0199999999999996 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.9500000000000002 110.949 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 2.1000000000000001 104.109 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 1.47 107.087 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 1.8600000000000001 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 1.8100000000000001 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.6099999999999999 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 3.4399999999999999 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.5099999999999998 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 2.0099999999999998 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.5600000000000001 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 1.7 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.5600000000000001 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.474 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 2.04 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.8900000000000001 107.799 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.6899999999999999 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 1.9399999999999999 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 1.8799999999999999 110.017 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.7800000000000002 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 4.4000000000000004 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.8999999999999999 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.29 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 3.8399999999999999 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 2.48 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 2.79 110.524 165.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 5.3200000000000003 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7000000000000002 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.1200000000000001 108.647 168.702 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 3.2400000000000002 105.544 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.548 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 3.3599999999999999 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 2.8199999999999998 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.548 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.48999999999999999 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 2.6699999999999999 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 2.7999999999999998 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 3.7400000000000002 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.3100000000000001 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.98 113.072 -174.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.3700000000000001 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 1.48 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 1.46 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51000000000000001 109.128 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 1.8500000000000001 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.8600000000000003 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 5.0499999999999998 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 1.8 108.981 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.3300000000000001 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.8900000000000001 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 1.54 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 3.3700000000000001 111.071 171.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.77 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.83999999999999997 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 1.74 111.561 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 1.6699999999999999 110.877 -175.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.32000000000000001 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 1.71 111.459 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.54 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 2.7999999999999998 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 3.5099999999999998 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.4700000000000002 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 4.0 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 1.6499999999999999 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 3.1899999999999999 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 1.6699999999999999 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.72 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2000000000000002 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.9500000000000002 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 2.29 105.048 -178.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 1.74 104.73 -179.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 1.8 106.798 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.0800000000000001 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 1.7 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.6099999999999999 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 3.5899999999999999 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.0899999999999999 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 1.6699999999999999 110.904 -174.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.8399999999999999 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 1.73 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.8500000000000001 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 1.6899999999999999 110.141 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.9199999999999999 108.816 -173.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.9099999999999999 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 1.75 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 1.8200000000000001 111.756 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 2.0899999999999999 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 4.6100000000000003 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 1.49 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.56999999999999995 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 3.1499999999999999 109.265 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 2.4500000000000002 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 3.2999999999999998 111.218 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 5.71 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.1600000000000001 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.8500000000000001 108.582 170.902 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 108.963 -0.754 . . . . 3.7000000000000002 108.963 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.562 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 3.5 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 2.6800000000000002 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.44 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 2.8199999999999998 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.5299999999999998 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 2.4900000000000002 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.4199999999999999 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.71 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.4199999999999999 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64000000000000001 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 1.45 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 1.55 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 1.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 4.0999999999999996 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 3.7999999999999998 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 2.0600000000000001 110.467 -172.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.8300000000000001 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.5899999999999999 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 1.6599999999999999 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 2.96 110.606 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 4.4900000000000002 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 1.0800000000000001 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 1.5600000000000001 112.273 -167.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 1.3500000000000001 110.631 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.39000000000000001 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 1.71 112.258 -169.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.4299999999999999 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 3.2000000000000002 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 3.0800000000000001 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.3500000000000001 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 2.75 108.697 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 1.8200000000000001 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 3.23 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 1.5800000000000001 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 2.1600000000000001 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.2699999999999996 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 3.23 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 1.9399999999999999 105.3 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 1.6499999999999999 105.942 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 1.8400000000000001 106.477 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.8300000000000001 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.6200000000000001 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 3.6499999999999999 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.3199999999999998 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 1.55 113.635 176.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 3.3999999999999999 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 1.6699999999999999 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.1899999999999999 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.418 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 1.55 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 1.51 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 1.6200000000000001 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 1.8700000000000001 110.218 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.8600000000000001 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 4.1799999999999997 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 1.5600000000000001 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.47999999999999998 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 3.1499999999999999 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 2.0600000000000001 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 2.75 113.019 171.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.8900000000000001 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.0699999999999998 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.5099999999999998 110.821 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 3.8799999999999999 106.502 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.526 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 3.2999999999999998 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.9399999999999999 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.526 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.46999999999999997 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 2.4199999999999999 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.9399999999999999 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 3.8999999999999999 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.7400000000000002 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 3.1699999999999999 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.5600000000000001 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.73999999999999999 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 1.78 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 1.54 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 1.7 111.042 175.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 4.1799999999999997 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 4.5599999999999996 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 1.75 108.423 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.8500000000000001 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 3.4900000000000002 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 1.5800000000000001 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 2.8999999999999999 110.039 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 5.0 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 1.03 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 1.9199999999999999 112.226 -171.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 1.55 109.501 178.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65000000000000002 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 1.79 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 1.27 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 3.71 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 3.5099999999999998 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.2999999999999998 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 3.5299999999999998 107.742 174.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 1.8500000000000001 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 3.2999999999999998 110.527 172.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 1.73 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 2.0 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.1200000000000001 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.7999999999999998 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 2.0499999999999998 104.231 178.48 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 1.72 105.226 178.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 1.6899999999999999 106.203 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.3700000000000001 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.72 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.8399999999999999 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 5.0 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.2799999999999998 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 1.6399999999999999 114.412 178.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 3.2799999999999998 112.617 173.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 1.8899999999999999 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.0099999999999998 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 1.6399999999999999 109.728 -174.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.1099999999999999 109.892 -176.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 1.3999999999999999 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 1.52 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 1.8 110.423 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.8600000000000001 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.8399999999999999 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 1.47 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51000000000000001 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 3.2400000000000002 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 2.23 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 3.4399999999999999 112.941 179.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 5.1299999999999999 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.8700000000000001 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.9299999999999999 109.574 170.339 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 4.5700000000000003 103.846 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.55 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 3.3900000000000001 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 2.3300000000000001 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.55 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.69999999999999996 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 2.52 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 3.77 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 2.5299999999999998 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.5700000000000001 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 3.0299999999999998 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76000000000000001 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 1.51 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 1.73 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 1.48 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 4.3700000000000001 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 4.6299999999999999 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 1.9299999999999999 110.001 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.8200000000000001 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.0699999999999998 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 1.6599999999999999 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 3.1800000000000002 111.167 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 2.4199999999999999 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 1.03 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 1.78 112.586 -171.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 1.79 110.782 -177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.44 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 1.5800000000000001 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.4299999999999999 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 2.7799999999999998 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 3.4199999999999999 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.8899999999999999 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 3.8100000000000001 107.839 175.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 1.78 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 3.2400000000000002 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 1.6899999999999999 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 2.0800000000000001 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.3900000000000001 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 3.0800000000000001 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.416 ' CD2' HD21 ' A' ' 60' ' ' LEU 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 2.1200000000000001 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 1.6200000000000001 105.571 -178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 1.9199999999999999 108.047 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.2599999999999998 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 1.5 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.5099999999999998 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 3.6499999999999999 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.1299999999999999 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 1.5900000000000001 111.758 173.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.75 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 1.8400000000000001 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.4500000000000002 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 1.7 109.613 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.0699999999999998 109.689 -168.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 1.45 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 1.8200000000000001 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 1.9399999999999999 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.8500000000000001 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 4.4199999999999999 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 1.45 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.46000000000000002 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 3.6499999999999999 110.152 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 2.4500000000000002 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 2.73 114.74 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 5.4199999999999999 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.9700000000000002 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.4199999999999999 108.634 169.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 3.21 107.479 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.489 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 3.25 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 3.0299999999999998 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.489 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.69999999999999996 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 4.1900000000000004 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.71 109.851 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.71 106.113 169.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.3999999999999999 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.8500000000000001 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76000000000000001 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 1.5800000000000001 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 1.6100000000000001 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.46999999999999997 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 1.3500000000000001 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 5.6699999999999999 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 3.8500000000000001 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 1.5900000000000001 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.1499999999999999 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.6699999999999999 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 1.6799999999999999 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 3.3300000000000001 110.728 175.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 3.54 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.85999999999999999 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 1.77 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 1.3700000000000001 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.46000000000000002 113.455 -171.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 1.7 110.927 -177.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 1.1699999999999999 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 2.6400000000000001 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 3.5800000000000001 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.2200000000000002 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 2.6899999999999999 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 2.0800000000000001 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 3.4300000000000002 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 1.6000000000000001 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.8400000000000001 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.7799999999999998 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 3.8599999999999999 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 1.8300000000000001 104.818 173.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 1.6899999999999999 106.237 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 2.0299999999999998 107.25 -171.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.3100000000000001 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 1.6399999999999999 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.1400000000000001 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 5.0499999999999998 103.797 -170.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.5299999999999998 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 1.8300000000000001 113.378 -172.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 3.6600000000000001 111.061 -170.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 1.9399999999999999 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7000000000000002 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.412 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 1.6299999999999999 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.71 107.886 -174.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 1.5600000000000001 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 1.6599999999999999 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 1.75 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.98 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 6.3899999999999997 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 2.0499999999999998 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77000000000000002 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 3.27 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 2.6000000000000001 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 3.3599999999999999 113.345 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.96 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.409 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.5899999999999999 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.8500000000000001 109.109 172.709 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.442 -0.857 0 N-CA-C 108.044 -1.095 . . . . 3.4900000000000002 108.044 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.485 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 3.46 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 2.6299999999999999 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.485 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.52000000000000002 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 3.1200000000000001 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 3.2000000000000002 109.944 -172.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 3.6299999999999999 108.925 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.1200000000000001 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 3.0699999999999998 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.003 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.003 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.59999999999999998 110.457 -171.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 1.47 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 1.6200000000000001 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.46999999999999997 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 1.23 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 6.1399999999999997 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 3.5099999999999998 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 1.6599999999999999 108.333 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.8199999999999998 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 1.8500000000000001 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 2.8799999999999999 110.671 170.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 2.23 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 1.1399999999999999 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 1.6399999999999999 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 1.46 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.47999999999999998 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 1.71 110.932 -171.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 1.21 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 3.4900000000000002 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 3.4399999999999999 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 2.6899999999999999 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 1.9399999999999999 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 3.2400000000000002 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 1.5700000000000001 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 2.0899999999999999 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.3500000000000001 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 3.23 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 2.0699999999999998 106.003 177.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 1.78 103.516 -178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 2.1600000000000001 105.018 -176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.3799999999999999 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 1.6799999999999999 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.3900000000000001 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 5.0599999999999996 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.3700000000000001 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 1.8 111.827 -171.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.6899999999999999 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 1.8500000000000001 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.9300000000000002 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 1.6499999999999999 108.849 176.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.6899999999999999 111.265 -173.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.6699999999999999 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 1.72 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 1.8799999999999999 110.872 175.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.8500000000000001 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 3.4100000000000001 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 1.55 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.58999999999999997 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 3.3300000000000001 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 3.3199999999999998 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 2.75 113.674 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.8900000000000001 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.5800000000000001 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.5299999999999998 110.511 -169.247 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 3.6000000000000001 107.765 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.557 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 3.8700000000000001 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 3.1000000000000001 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.557 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.42999999999999999 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 3.1600000000000001 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 2.5899999999999999 113.754 -171.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.8900000000000001 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.4299999999999999 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 4.0700000000000003 112.896 -163.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.1799999999999999 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66000000000000003 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 1.55 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 1.6499999999999999 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.48999999999999999 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 1.3600000000000001 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 6.2400000000000002 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 5.2999999999999998 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 1.55 109.045 178.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.8999999999999999 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.7200000000000002 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 1.5900000000000001 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 2.9900000000000002 111.536 172.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.6800000000000002 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 1.1100000000000001 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 1.6200000000000001 112.115 -169.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 1.6899999999999999 110.645 -178.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.40999999999999998 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 1.8500000000000001 112.117 -169.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.3899999999999999 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 3.0099999999999998 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 3.3500000000000001 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 3.6699999999999999 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 1.72 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 3.2000000000000002 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 1.5600000000000001 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.98 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.3600000000000003 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 4.25 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 1.79 104.916 174.495 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 1.75 103.666 179.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 2.1499999999999999 106.537 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.1299999999999999 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.7 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.5699999999999998 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 3.5299999999999998 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.1600000000000001 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 1.6699999999999999 113.473 176.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 3.6200000000000001 112.64 179.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 1.8500000000000001 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.0699999999999998 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 1.54 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.1499999999999999 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 1.4199999999999999 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 1.49 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 1.71 110.116 175.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.8899999999999999 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 4.8099999999999996 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 1.72 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55000000000000004 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 3.1899999999999999 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 2.3300000000000001 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 3.3300000000000001 113.112 174.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 5.5199999999999996 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.7200000000000002 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.6299999999999999 110.009 166.787 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 4.6399999999999997 107.076 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.607 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 3.6000000000000001 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 2.73 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.607 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.81000000000000005 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 3.0299999999999998 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 4.1900000000000004 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.52 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.6200000000000001 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 8.4600000000000009 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.8100000000000001 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.103 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 2.0 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 1.8700000000000001 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 1.103 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.3600000000000001 107.023 173.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 1.3999999999999999 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 7.7699999999999996 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 4.1399999999999997 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 1.73 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.8400000000000001 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 3.54 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 1.73 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 3.2200000000000002 111.139 175.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 2.2999999999999998 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 1.0900000000000001 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 1.8300000000000001 112.121 -170.086 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 1.9399999999999999 109.8 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.69999999999999996 114.33 -177.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 1.5700000000000001 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.72 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 3.7200000000000002 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 3.2200000000000002 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.8400000000000001 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 3.5099999999999998 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 1.8200000000000001 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 3.1800000000000002 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 1.6799999999999999 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.98 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.6699999999999999 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 3.48 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 1.97 105.629 177.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 1.8600000000000001 106.58 171.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 1.9099999999999999 108.401 171.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 1.8300000000000001 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.2999999999999998 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 4.5199999999999996 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.4700000000000002 111.457 171.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 1.8100000000000001 112.675 -174.154 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.5699999999999998 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 1.6000000000000001 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.1099999999999999 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 1.6699999999999999 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.8599999999999999 109.045 -166.584 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 2.79 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 1.5 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 1.97 110.912 176.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.8500000000000001 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 4.3300000000000001 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 1.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55000000000000004 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 3.3900000000000001 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.99 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 2.7400000000000002 113.212 176.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 7.5199999999999996 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.7400000000000002 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.9299999999999999 109.547 165.506 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 4.21 108.614 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.563 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 3.21 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 2.4100000000000001 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.563 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.62 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 2.5499999999999998 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 2.6200000000000001 112.02 -161.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 2.8100000000000001 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.3100000000000001 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 3.3399999999999999 112.643 -166.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.4199999999999999 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.65000000000000002 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 1.6100000000000001 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 1.52 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 1.8400000000000001 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.9699999999999998 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.8999999999999999 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 1.8300000000000001 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6000000000000001 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 1.6899999999999999 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 2.79 110.945 174.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 2.3900000000000001 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.84999999999999998 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 1.96 112.359 -170.249 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 1.8300000000000001 110.789 -176.345 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.46000000000000002 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 1.7 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.51 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 2.8300000000000001 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 3.9500000000000002 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.6599999999999999 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 2.8999999999999999 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 1.9199999999999999 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 3.1800000000000002 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.6100000000000001 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 3.3199999999999998 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 4.1900000000000004 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 1.99 103.609 168.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 1.52 103.775 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 1.7 106.971 -177.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.1200000000000001 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 1.55 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.3599999999999999 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 3.6899999999999999 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.1099999999999999 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 1.6100000000000001 108.672 173.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 3.96 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 1.8400000000000001 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.1699999999999999 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 1.6599999999999999 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.6499999999999999 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.46 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 1.6499999999999999 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 1.9299999999999999 110.322 173.501 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.8400000000000001 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 3.4700000000000002 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 1.6100000000000001 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.60999999999999999 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 3.25 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.8300000000000001 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 2.8900000000000001 113.763 172.764 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 4.0499999999999998 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.3500000000000001 108.948 167.089 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 3.79 106.429 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.51 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 3.3300000000000001 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 2.5 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.51 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.56000000000000005 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 3.2000000000000002 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 2.7000000000000002 109.559 -168.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 3.6099999999999999 108.076 -175.596 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.6200000000000001 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.9199999999999999 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.252 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.4099999999999999 115.156 -176.465 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.252 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68000000000000005 109.338 -167.58 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 1.6200000000000001 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 1.7 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.47999999999999998 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 1.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 5.54 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 3.8900000000000001 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 2.0699999999999998 109.629 178.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.6299999999999999 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 1.8899999999999999 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 3.1299999999999999 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 2.4500000000000002 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.3500000000000001 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 1.6200000000000001 112.186 -170.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 1.53 109.317 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51000000000000001 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 1.6799999999999999 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.9399999999999999 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 2.5699999999999998 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 3.0 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 2.71 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 1.75 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 3.2200000000000002 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 1.72 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 1.8899999999999999 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.8200000000000003 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 4.0999999999999996 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 1.8100000000000001 105.774 169.984 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 1.6699999999999999 106.192 172.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 1.8500000000000001 106.464 -177.151 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.8900000000000001 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 1.74 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.7200000000000002 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 4.8799999999999999 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.2400000000000002 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 1.76 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 3.3999999999999999 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 1.98 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.0499999999999998 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.434 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 1.6499999999999999 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 3.0499999999999998 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 1.55 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 1.8300000000000001 110.527 175.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.9199999999999999 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 4.7999999999999998 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 1.53 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.59999999999999998 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 3.04 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 2.1899999999999999 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 2.7999999999999998 112.646 172.497 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 5.75 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.8799999999999999 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 . . . . . 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.1899999999999999 108.194 163.988 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 3.7000000000000002 105.983 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 3.3500000000000001 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 3.0899999999999999 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.496 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.58999999999999997 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 2.5299999999999998 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 3.7000000000000002 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 2.5699999999999998 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 3.2599999999999998 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65000000000000002 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 1.77 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 1.6499999999999999 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52000000000000002 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 1.5900000000000001 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 5.7400000000000002 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 3.75 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 1.76 110.106 178.377 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.8400000000000001 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 3.8100000000000001 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 1.71 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 2.8100000000000001 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 2.4100000000000001 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.71 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 1.5800000000000001 111.647 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 1.5600000000000001 110.607 177.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45000000000000001 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 2.0299999999999998 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.9199999999999999 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 3.52 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 2.9100000000000001 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.0099999999999998 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 2.6899999999999999 109.44 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 1.55 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 3.27 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 1.8100000000000001 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 1.8 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.8300000000000001 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.96 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 2.2000000000000002 106.228 170.278 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 1.72 106.814 170.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 1.8300000000000001 106.403 -178.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.6299999999999999 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.8200000000000001 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.8399999999999999 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 3.73 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.4399999999999999 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 2.0 113.16 -173.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.54 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 1.7 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.04 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.435 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 2.1499999999999999 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 68' ' ' ARG . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.6600000000000001 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.6200000000000001 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 1.8200000000000001 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 1.8 109.621 175.541 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.3700000000000001 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 4.4500000000000002 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 1.8300000000000001 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.71999999999999997 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 3.73 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.8400000000000001 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 2.6400000000000001 112.197 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 57' ' ' GLU . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 7.5999999999999996 107.031 168.67 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.6699999999999999 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 . . . . . 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.9299999999999999 109.926 168.926 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 4.2199999999999998 106.078 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 3.2000000000000002 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 2.3399999999999999 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.483 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.78000000000000003 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 4.3700000000000001 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.8700000000000001 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 2.7599999999999998 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.3799999999999999 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 3.6600000000000001 111.288 -178.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.5600000000000001 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65000000000000002 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 1.8500000000000001 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 1.52 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 1.52 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.9300000000000002 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 4.6500000000000004 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 1.6799999999999999 109.349 179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.0899999999999999 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 1.71 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 3.3300000000000001 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 4.5 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.79000000000000004 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 1.73 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 1.8400000000000001 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.44 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 1.6499999999999999 111.695 -171.019 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.4199999999999999 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 2.8999999999999999 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 3.4700000000000002 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.9399999999999999 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 3.0800000000000001 110.198 -175.224 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 1.78 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 3.2799999999999998 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 1.6399999999999999 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 1.8400000000000001 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.0599999999999996 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 3.6800000000000002 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 2.02 105.876 171.686 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 1.6599999999999999 105.791 175.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 2.0699999999999998 108.415 171.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.1299999999999999 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.75 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.8399999999999999 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.431 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 3.1099999999999999 106.426 152.0 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.431 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.5899999999999999 107.537 -177.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 1.8899999999999999 111.681 -175.913 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.8399999999999999 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 1.8899999999999999 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.1600000000000001 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 1.6499999999999999 109.829 -179.561 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.0699999999999998 109.687 -174.433 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.6799999999999999 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 1.6200000000000001 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 1.8 109.648 172.809 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 6.1900000000000004 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 5.75 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 1.8600000000000001 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.83999999999999997 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 3.1000000000000001 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 2.23 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 3.2799999999999998 111.653 179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 6.4400000000000004 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.4900000000000002 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.3999999999999999 110.964 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 3.6699999999999999 106.814 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.522 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 3.2200000000000002 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 2.6000000000000001 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.522 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.46000000000000002 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 3.0 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.6699999999999999 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 3.3900000000000001 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 3.3300000000000001 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.5600000000000001 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.83999999999999997 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 1.9299999999999999 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 1.8 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66000000000000003 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 1.48 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 5.54 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 4.0899999999999999 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 1.5900000000000001 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.0600000000000001 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 3.3300000000000001 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 1.55 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 3.2400000000000002 111.23 174.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 2.25 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 2.2599999999999998 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 1.8400000000000001 111.512 -164.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 1.6100000000000001 110.401 178.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.47999999999999998 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 1.79 111.477 -178.323 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.74 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.9500000000000002 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 3.6099999999999999 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.6200000000000001 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 2.5899999999999999 107.1 178.028 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 1.78 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 3.25 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 1.8500000000000001 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 2.2400000000000002 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.1500000000000004 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 4.1600000000000001 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 2.0299999999999998 105.531 172.043 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 1.6799999999999999 101.934 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 2.2400000000000002 106.024 171.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.3500000000000001 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 1.8 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.3799999999999999 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 3.6899999999999999 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.1299999999999999 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 1.8100000000000001 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 3.5499999999999998 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 1.5 110.34 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.6499999999999999 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 1.8400000000000001 109.312 177.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 1.78 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 1.7 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 1.6399999999999999 109.925 174.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.8799999999999999 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 4.8499999999999996 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 1.51 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45000000000000001 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 3.25 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 2.1699999999999999 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 2.5600000000000001 112.495 173.14 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 7.8099999999999996 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.3300000000000001 108.028 170.878 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 4.0300000000000002 107.865 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.544 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 3.3900000000000001 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 2.73 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.544 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.58999999999999997 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 2.8399999999999999 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 4.0700000000000003 110.345 -169.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 3.0 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.1299999999999999 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 3.02 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.061 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.8100000000000001 114.13 -161.143 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.061 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.69999999999999996 108.381 -172.774 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 1.51 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 1.52 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.56999999999999995 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 1.5700000000000001 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 5.3099999999999996 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.7300000000000004 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 1.6299999999999999 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.4199999999999999 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.8599999999999999 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 1.51 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 3.23 111.388 173.063 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 2.3599999999999999 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.88 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 1.75 112.075 -173.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 1.45 109.995 -179.23 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.53000000000000003 113.372 -177.037 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 1.6299999999999999 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.6499999999999999 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 3.9300000000000002 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 3.3100000000000001 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.8300000000000001 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 2.7000000000000002 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 1.6200000000000001 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 3.3300000000000001 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 1.5600000000000001 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 2.0 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.8399999999999999 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 3.0800000000000001 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 2.04 106.043 173.164 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 1.6699999999999999 103.391 177.284 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 2.0099999999999998 106.586 175.078 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.1400000000000001 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 1.6000000000000001 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 4.8700000000000001 103.208 -163.931 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.1800000000000002 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 1.9199999999999999 113.181 -169.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.6200000000000001 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 1.6000000000000001 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.8900000000000001 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 1.8200000000000001 109.551 178.416 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.0099999999999998 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 2.2000000000000002 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 1.6200000000000001 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 1.8 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.98 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 6.4199999999999999 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 1.71 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.66000000000000003 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 3.1899999999999999 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 2.6899999999999999 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 3.4500000000000002 114.421 175.331 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 5.25 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.418 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.4199999999999999 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.4900000000000002 110.391 175.112 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 3.2000000000000002 106.995 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.472 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 3.2599999999999998 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 2.7599999999999998 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.472 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.53000000000000003 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 2.48 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 3.6499999999999999 108.579 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 3.4900000000000002 106.182 148.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.4399999999999999 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 3.6699999999999999 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66000000000000003 109.147 -168.931 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 1.55 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 1.4099999999999999 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51000000000000001 108.977 172.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 1.23 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.9900000000000002 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 3.8100000000000001 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 2.04 109.51 176.33 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.0299999999999998 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.75 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 2.0499999999999998 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 2.9900000000000002 111.061 175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.6400000000000001 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.24 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 1.7 112.148 -172.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 1.4099999999999999 111.394 -173.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.46000000000000002 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 1.6899999999999999 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.96 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.96 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 3.6499999999999999 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 3.6099999999999999 107.371 175.174 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 2.0299999999999998 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 3.25 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 1.71 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 2.2999999999999998 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1000000000000001 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 3.8100000000000001 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 2.0699999999999998 105.385 167.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 1.8200000000000001 103.196 173.73 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 2.1699999999999999 106.324 166.319 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.1800000000000002 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 1.6499999999999999 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.1699999999999999 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 3.5699999999999998 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.3500000000000001 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 1.6000000000000001 111.698 -174.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 3.1200000000000001 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 1.8700000000000001 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.7799999999999998 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 1.6699999999999999 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.7200000000000002 109.555 -174.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 1.47 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 1.48 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 1.8200000000000001 110.582 174.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.8700000000000001 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 3.6699999999999999 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 1.6799999999999999 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.57999999999999996 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 3.2999999999999998 109.999 177.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 3.3399999999999999 110.545 -169.537 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 2.7799999999999998 115.015 -174.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 4.9900000000000002 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.7599999999999998 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.1600000000000001 109.194 172.635 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 3.2000000000000002 106.995 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.472 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 3.2599999999999998 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 2.7599999999999998 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.472 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.53000000000000003 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 2.48 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 3.6499999999999999 108.579 -178.829 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 3.4900000000000002 106.182 148.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.4399999999999999 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 3.6699999999999999 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66000000000000003 109.147 -168.931 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 1.55 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 1.4099999999999999 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51000000000000001 108.977 172.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 1.23 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.9900000000000002 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 3.8100000000000001 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 2.04 109.51 176.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.0299999999999998 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.75 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 2.0499999999999998 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 2.9900000000000002 111.061 175.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.6400000000000001 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.24 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 1.7 112.148 -172.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 1.4099999999999999 111.394 -173.525 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.46000000000000002 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 1.6899999999999999 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.96 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.96 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 3.6499999999999999 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 3.6099999999999999 107.371 175.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 2.0299999999999998 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 3.25 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 1.71 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 2.2999999999999998 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1000000000000001 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 3.8100000000000001 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 2.0699999999999998 105.385 167.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 1.8200000000000001 103.196 173.73 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 2.1699999999999999 106.324 166.319 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.1800000000000002 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 1.6499999999999999 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.1699999999999999 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 3.5699999999999998 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.3500000000000001 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 1.6000000000000001 111.698 -174.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 3.1200000000000001 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 1.8700000000000001 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.7799999999999998 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 1.6699999999999999 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.7200000000000002 109.555 -174.568 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 1.47 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 1.48 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 1.8200000000000001 110.582 174.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.8700000000000001 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 3.6699999999999999 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 1.6799999999999999 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.57999999999999996 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 3.2999999999999998 109.999 177.786 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 3.3399999999999999 110.545 -169.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 2.7799999999999998 115.015 -174.683 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 4.9900000000000002 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.7599999999999998 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.1600000000000001 109.194 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 109.376 -0.601 . . . . 6.8799999999999999 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -59.21 -75.66 0.26 Allowed Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.208 0.909 . . . . 3.1099999999999999 112.717 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 m -144.14 157.81 44.09 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.166 -2.161 . . . . 2.3999999999999999 105.166 164.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.58 115.38 23.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 3.5299999999999998 107.123 170.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.592 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 3.1899999999999999 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 2.7999999999999998 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.592 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.63 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 2.5099999999999998 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.75 113.224 -161.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 2.5899999999999999 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.4099999999999999 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 3.23 111.152 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.4099999999999999 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68000000000000005 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 1.49 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 1.4399999999999999 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56000000000000005 108.087 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 1.48 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 6.7400000000000002 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 3.7999999999999998 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 1.9299999999999999 108.247 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.0600000000000001 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.71 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 1.8 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 2.9900000000000002 109.865 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 4.96 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.21 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 1.76 112.092 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 1.78 110.641 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.39000000000000001 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 1.7 111.979 -175.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.4099999999999999 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 2.73 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 3.5099999999999998 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.8799999999999999 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 2.8399999999999999 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 1.8500000000000001 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 3.3599999999999999 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 1.6100000000000001 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 1.9399999999999999 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.0999999999999996 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.8599999999999999 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 1.9399999999999999 106.792 170.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 1.6000000000000001 105.168 174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 1.6699999999999999 107.635 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.8200000000000001 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 1.6499999999999999 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.5299999999999998 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 3.54 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.0499999999999998 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 1.72 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 8.8699999999999992 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 1.55 111.792 173.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.2200000000000002 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.476 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 1.6599999999999999 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.6699999999999999 108.451 -167.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 2.3100000000000001 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 1.5700000000000001 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 1.71 110.965 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.8500000000000001 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 3.8700000000000001 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 1.7 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.58999999999999997 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 3.23 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.8199999999999998 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 2.8999999999999999 110.999 168.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 4.0599999999999996 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -108.28 58.72 0.61 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.3999999999999999 110.622 170.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 63.64 -176.77 0.16 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.652 0.781 . . . . 3.9500000000000002 110.208 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -104.05 74.86 1.23 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 107.949 -1.13 . . . . 3.0499999999999998 107.949 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.46 -158.22 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.038 1.335 . . . . 3.3999999999999999 111.061 -174.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 . . . . . 0 C--O 1.25 1.082 0 N-CA-C 104.314 -2.476 . . . . 8.8100000000000005 104.314 -178.108 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 109.808 -0.442 . . . . 5.9699999999999998 109.808 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 126.42 5.5 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 106.021 -2.832 . . . . 2.3799999999999999 106.021 -157.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.3 m -143.52 103.8 4.14 Favored 'General case' 0 CA--C 1.506 -0.716 0 CA-C-N 118.856 1.328 . . . . 2.21 108.231 170.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -91.72 123.74 35.34 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 4.54 106.052 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 3.3900000000000001 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 2.7999999999999998 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.38 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 2.5 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 3.0 110.128 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.8199999999999998 105.533 169.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.9100000000000001 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.0800000000000001 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 2.0600000000000001 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 2.1600000000000001 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 1.54 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.0700000000000001 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 1.6799999999999999 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 5.2999999999999998 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.9900000000000002 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 1.76 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.8300000000000001 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 3.6400000000000001 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 1.48 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 3.3300000000000001 111.016 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.96 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.3200000000000001 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 2.2000000000000002 111.836 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 2.0499999999999998 109.722 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.60999999999999999 113.477 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 1.74 111.802 -169.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.4199999999999999 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 2.6400000000000001 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 3.7799999999999998 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 2.8100000000000001 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 3.0299999999999998 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 4.9800000000000004 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 2.8199999999999998 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.9500000000000002 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.1799999999999997 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.96 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 2.3199999999999998 106.644 176.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 1.52 105.288 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 1.95 107.236 176.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.4300000000000002 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 1.72 112.086 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.4900000000000002 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 4.75 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.8500000000000001 111.05 166.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 1.6599999999999999 112.181 -174.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 3.02 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 1.78 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.5699999999999998 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 1.6200000000000001 108.772 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.51 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 1.6000000000000001 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 1.6100000000000001 111.012 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.8999999999999999 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.7200000000000002 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 1.8500000000000001 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89000000000000001 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 3.2999999999999998 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 2.1400000000000001 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 3.23 111.889 -178.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.9700000000000002 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.8300000000000001 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -125.32 58.92 1.27 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 70.04 159.25 0.19 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.003 1.721 . . . . 3.73 113.889 163.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 81.24 8.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.581 -1.19 . . . . 2.6600000000000001 108.717 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 72.35 -68.24 0.23 Allowed 'General case' 0 C--O 1.231 0.082 0 C-N-CA 124.994 1.317 . . . . 2.8700000000000001 111.523 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.123 -0.942 . . . . 7.1100000000000003 108.868 -162.016 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 m . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.843 -0.429 . . . . 6.4199999999999999 109.843 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 144.44 77.38 0.03 OUTLIER Glycine 0 CA--C 1.529 0.967 0 N-CA-C 109.673 -1.371 . . . . 2.6000000000000001 109.673 -174.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -109.15 108.32 18.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.596 1.158 . . . . 2.1499999999999999 108.462 -172.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -95.56 115.79 27.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 3.71 109.163 -169.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.512 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 3.21 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 2.3500000000000001 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.512 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.58999999999999997 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 2.8500000000000001 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 3.8500000000000001 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.75 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.2200000000000002 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 3.1899999999999999 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.3899999999999999 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.69999999999999996 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 1.5900000000000001 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 1.4199999999999999 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.46000000000000002 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 1.3600000000000001 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.9700000000000002 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 4.8799999999999999 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 1.7 109.946 175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.1099999999999999 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.8700000000000001 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 1.79 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 2.8799999999999999 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 2.25 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.85999999999999999 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 1.6399999999999999 112.013 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 1.3799999999999999 109.737 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45000000000000001 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 1.51 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 1.2 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 3.6899999999999999 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 3.2200000000000002 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.9199999999999999 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 2.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 1.6899999999999999 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 3.3500000000000001 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 1.6399999999999999 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 1.8300000000000001 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.1200000000000001 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 3.6600000000000001 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 1.9199999999999999 107.503 176.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 1.6299999999999999 106.233 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 1.71 107.397 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.1400000000000001 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 1.54 109.058 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.6400000000000001 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 4.9900000000000002 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.4399999999999999 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 1.6799999999999999 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 3.2599999999999998 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 1.53 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.8900000000000001 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 1.6000000000000001 109.616 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.4199999999999999 108.691 -169.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 2.8900000000000001 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 1.5 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 1.78 110.737 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.3099999999999996 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 5.2400000000000002 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 1.6399999999999999 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 3.3300000000000001 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 2.6299999999999999 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 3.1299999999999999 111.401 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 4.1100000000000003 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.3899999999999997 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -139.91 51.48 1.71 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 53.71 -169.33 0.06 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.781 -0.645 . . . . 3.9900000000000002 112.203 170.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.64 63.71 1.04 Allowed 'General case' 0 C--N 1.34 0.175 0 O-C-N 120.627 -1.296 . . . . 2.9100000000000001 110.138 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.76 68.79 0.68 Allowed 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.569 1.147 . . . . 2.7400000000000002 108.417 -169.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 C--O 1.25 1.083 0 O-C-N 125.124 1.515 . . . . 6.4400000000000004 107.606 -162.007 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 107.123 -1.436 . . . . 5.7400000000000002 107.123 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.21 133.31 2.88 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.126 1.346 . . . . 2.4399999999999999 109.924 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 m -140.24 146.61 38.85 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 105.515 -2.032 . . . . 2.0899999999999999 105.515 159.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.32 122.23 46.89 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 3.2999999999999998 107.452 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.553 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 3.3399999999999999 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 2.96 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.553 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.48999999999999999 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 3.25 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 3.5499999999999998 111.135 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.7200000000000002 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.0499999999999998 105.306 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.96 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.68999999999999995 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 1.54 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 1.6100000000000001 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.46999999999999997 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 1.5600000000000001 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 6.0099999999999998 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 3.5 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 1.76 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.8300000000000001 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.6600000000000001 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 1.76 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.412 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 3.2599999999999998 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 2.5499999999999998 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.1299999999999999 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 1.73 110.938 -171.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 1.95 109.143 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.57999999999999996 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 1.7 112.045 -172.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 1.27 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 2.71 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 3.6800000000000002 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.6299999999999999 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 2.79 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 1.8400000000000001 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 3.1499999999999999 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 1.7 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 2.0099999999999998 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.5299999999999998 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 4.29 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 1.8700000000000001 104.894 172.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 1.76 105.313 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 1.9399999999999999 107.633 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.6600000000000001 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 1.51 110.494 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.4100000000000001 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 5.0300000000000002 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.0299999999999998 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 1.6100000000000001 112.722 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 3.3300000000000001 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 1.8600000000000001 111.176 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.8599999999999999 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.416 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 1.75 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.4100000000000001 110.233 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.51 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 1.6499999999999999 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.412 ' CD1' HG23 ' A' ' 26' ' ' VAL . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 1.73 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.8200000000000001 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 3.5699999999999998 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 1.5700000000000001 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.57999999999999996 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 3.4300000000000002 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 2.46 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 3.0099999999999998 113.02 -175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 4.3799999999999999 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.6099999999999999 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.49 58.37 1.39 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7000000000000002 109.622 164.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 61.28 -171.55 0.15 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.868 -1.06 . . . . 3.7999999999999998 110.75 162.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -128.26 73.43 1.48 Allowed 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.349 -0.844 . . . . 2.96 109.675 -171.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.55 -56.84 0.51 Allowed 'General case' 0 C--O 1.231 0.108 0 C-N-CA 126.029 1.732 . . . . 2.98 110.884 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 116.97 -1.491 . . . . 8.2799999999999994 107.704 158.864 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 CA--C 1.524 -0.042 0 N-CA-C 107.911 -1.144 . . . . 5.9400000000000004 107.911 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.68 160.02 37.9 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 109.588 -1.405 . . . . 2.2000000000000002 109.588 167.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -142.88 123.25 13.88 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 107.097 -1.446 . . . . 2.1299999999999999 107.097 168.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.29 125.86 41.09 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 4.4699999999999998 107.624 175.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.506 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 3.7599999999999998 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 2.3700000000000001 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.506 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.59999999999999998 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 3.96 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 3.75 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 2.73 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.4099999999999999 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 3.1099999999999999 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.1899999999999999 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.70999999999999996 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 1.8500000000000001 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 1.6200000000000001 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.48999999999999999 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 1.52 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 4.4699999999999998 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 4.0 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 1.6100000000000001 109.345 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.6699999999999999 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.1099999999999999 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 1.6000000000000001 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 3.3900000000000001 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.6600000000000001 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.83999999999999997 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 1.71 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 1.8200000000000001 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.34000000000000002 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 1.77 112.061 -169.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 1.23 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 3.0299999999999998 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 3.2999999999999998 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.8700000000000001 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 2.5600000000000001 106.58 171.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 1.8700000000000001 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 3.23 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 1.6899999999999999 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 1.8899999999999999 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.4699999999999998 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 4.4299999999999997 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 1.96 104.312 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 1.75 103.189 -176.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 1.9399999999999999 107.398 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 1.5900000000000001 111.023 -172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.3700000000000001 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 3.6000000000000001 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.3500000000000001 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 1.6200000000000001 111.382 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.8799999999999999 109.771 -164.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 1.5900000000000001 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.6800000000000002 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 1.6399999999999999 109.116 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.55 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 1.5600000000000001 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 1.8999999999999999 110.423 174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.8400000000000001 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 3.52 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 1.5 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54000000000000004 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 3.3799999999999999 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 2.2400000000000002 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 3.46 114.132 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 5.0199999999999996 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.8100000000000001 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -118.18 55.71 0.88 Allowed 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.4100000000000001 108.14 162.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 57.24 -174.69 0.07 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.512 1.149 . . . . 3.8399999999999999 111.445 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -119.09 112.94 20.17 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.191 -2.152 . . . . 2.8599999999999999 105.191 170.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.94 -175.29 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.021 -1.103 . . . . 4.5199999999999996 108.021 163.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.305 -0.855 . . . . 11.31 109.314 176.642 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.846 0.355 . . . . 4.8899999999999997 110.421 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 57.61 -130.41 50.96 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.453 -1.059 . . . . 2.2799999999999998 110.453 -174.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.8 m -143.49 166.26 25.28 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 106.244 -1.761 . . . . 2.1800000000000002 106.244 163.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -118.91 126.16 51.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 3.75 106.268 163.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.538 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 3.2599999999999998 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 2.5899999999999999 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.538 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.58999999999999997 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 5.3200000000000003 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 2.8999999999999999 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 3.48 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.8500000000000001 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 1.52 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 1.3899999999999999 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45000000000000001 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 1.1399999999999999 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.9900000000000002 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 3.0899999999999999 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 1.9399999999999999 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.3599999999999999 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6000000000000001 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 1.5600000000000001 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 3.27 111.112 170.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 2.3799999999999999 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.21 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 1.6899999999999999 111.45 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 1.46 110.382 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.40000000000000002 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 1.6200000000000001 112.286 -173.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.6100000000000001 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 2.77 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 3.48 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.6299999999999999 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 4.0300000000000002 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 1.98 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 3.3300000000000001 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 1.52 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 2.2999999999999998 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.0199999999999996 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 3.6899999999999999 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 2.02 104.448 -176.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 1.6399999999999999 104.61 -177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 2.0 107.246 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.3999999999999999 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 1.6200000000000001 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.3399999999999999 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 3.48 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.1600000000000001 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 1.74 111.729 -177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.9399999999999999 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 1.49 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.9199999999999999 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 1.7 109.932 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1000000000000001 109.544 -172.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 1.49 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 1.71 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 1.75 110.365 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.8500000000000001 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 3.7000000000000002 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 1.4199999999999999 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46000000000000002 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 3.25 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 2.1400000000000001 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 2.6299999999999999 112.6 176.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.9500000000000002 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.7999999999999998 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -118.02 55.55 0.88 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.3399999999999999 110.217 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.8 143.36 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.565 1.546 . . . . 5.9299999999999997 112.556 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.22 72.66 4.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.764 -1.107 . . . . 2.79 108.931 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 83.27 -158.93 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 2.9199999999999999 111.372 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.208 -2.515 . . . . 7.9100000000000001 104.208 176.943 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 105.017 -2.216 . . . . 6.6799999999999997 105.017 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.4 152.5 21.96 Favored Glycine 0 N--CA 1.444 -0.81 0 N-CA-C 103.974 -3.65 . . . . 2.9900000000000002 103.974 159.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.3 m -135.17 110.65 9.12 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 119.237 1.519 . . . . 2.21 108.003 169.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.48 120.76 33.28 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 3.9700000000000002 105.172 174.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 3.3300000000000001 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 2.6299999999999999 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.553 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.60999999999999999 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 2.3100000000000001 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.5099999999999998 112.542 -163.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.7799999999999998 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.9700000000000002 112.299 -170.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 1.6299999999999999 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 1.77 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 1.3200000000000001 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 4.1399999999999997 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 3.1099999999999999 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 1.76 108.684 175.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.8999999999999999 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 1.7 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 3.2599999999999998 111.434 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.6400000000000001 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.96999999999999997 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 1.5900000000000001 111.548 -172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 1.51 111.175 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.44 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 1.6200000000000001 111.319 -175.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.75 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 3.2799999999999998 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 3.29 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.4900000000000002 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 2.4700000000000002 109.302 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 1.6799999999999999 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 3.2000000000000002 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 1.77 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.6299999999999999 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.6400000000000001 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 3.0699999999999998 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 1.6599999999999999 105.123 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 1.8600000000000001 106.499 173.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 1.9299999999999999 108.457 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.71 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.5600000000000001 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 3.7000000000000002 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.8700000000000001 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 1.77 111.298 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 4.1500000000000004 111.775 -176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 1.6299999999999999 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1000000000000001 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.517 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 1.5900000000000001 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.4300000000000002 110.482 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 1.4399999999999999 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 1.6299999999999999 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 1.6899999999999999 110.212 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.8899999999999999 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.7599999999999998 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 1.47 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 3.2799999999999998 110.942 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 3.2599999999999998 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 2.73 113.609 174.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.98 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.5699999999999998 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -117.94 57.36 0.83 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.3599999999999999 110.2 171.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 69.04 148.29 0.06 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 125.85 1.66 . . . . 3.7400000000000002 112.385 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.38 77.37 7.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.956 -1.02 . . . . 3.21 109.841 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 70.44 -176.88 0.2 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.758 0.823 . . . . 3.23 111.517 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.021 1.328 . . . . 7.9500000000000002 109.787 178.886 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.539 0.537 0 CA-C-O 119.144 -0.455 . . . . 7.4199999999999999 110.793 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.23 136.95 8.79 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.427 -1.069 . . . . 3.48 110.427 -174.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.66 126.75 40.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.714 -1.588 . . . . 2.4399999999999999 106.714 178.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -96.51 137.6 35.35 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 3.3500000000000001 107.457 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 3.2200000000000002 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 2.5800000000000001 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.532 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.53000000000000003 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 2.71 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.6899999999999999 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.6899999999999999 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.3600000000000001 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 3.1899999999999999 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.60999999999999999 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 1.74 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 1.72 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.48999999999999999 109.046 172.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 1.27 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 5.1699999999999999 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 3.1099999999999999 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 1.8100000000000001 109.838 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.8500000000000001 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 3.6699999999999999 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 1.73 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 3.5299999999999998 110.679 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 2.5299999999999998 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 1.03 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 2.4700000000000002 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 1.98 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.56999999999999995 113.269 -170.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 1.5700000000000001 110.841 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 1.22 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 3.25 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 3.2599999999999998 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.6200000000000001 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 2.5800000000000001 106.412 173.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 1.6899999999999999 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 3.3100000000000001 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 1.5600000000000001 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 1.8200000000000001 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.6099999999999999 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 3.8399999999999999 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 2.0699999999999998 105.429 175.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 1.71 103.065 -178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 2.1600000000000001 107.292 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.1200000000000001 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 1.52 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 4.6399999999999997 104.312 -170.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 1.8200000000000001 113.932 -177.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 3.21 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 1.6799999999999999 111.011 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.2400000000000002 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 1.9099999999999999 108.582 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 2.0800000000000001 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 1.6399999999999999 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 1.73 110.633 176.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.8500000000000001 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 3.46 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 1.72 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.42999999999999999 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 3.3399999999999999 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 3.21 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 2.8100000000000001 113.563 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 4.0899999999999999 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.7200000000000002 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -120.54 61.3 0.88 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 64.3 -177.87 0.17 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.981 0.912 . . . . 5.0899999999999999 111.936 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.76 62.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 107.613 -1.255 . . . . 2.7400000000000002 107.613 -175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.87 -51.4 0.57 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 126.038 1.735 . . . . 3.3399999999999999 111.153 -166.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 65.6 mt-10 . . . . . 0 C--O 1.258 1.518 0 C-N-CA 127.603 2.361 . . . . 6.4500000000000002 105.918 166.936 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 107.375 -1.343 . . . . 5.3300000000000001 107.375 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.62 -178.89 44.08 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.657 -1.377 . . . . 2.0600000000000001 109.657 169.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.89 119.04 13.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.267 -1.383 . . . . 2.3500000000000001 107.267 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.67 128.44 42.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 4.46 107.607 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 3.5699999999999998 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 2.6000000000000001 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.68999999999999995 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 3.75 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 3.8700000000000001 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.7000000000000002 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.4299999999999999 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.71 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.5900000000000001 113.649 -174.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.77000000000000002 108.96 -168.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 1.6299999999999999 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 1.6399999999999999 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56000000000000005 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 1.8999999999999999 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 5.0099999999999998 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 3.4399999999999999 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 1.6899999999999999 110.277 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.8600000000000001 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 3.1400000000000001 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 1.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 2.7000000000000002 111.201 176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 5.29 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 1.1299999999999999 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 1.8100000000000001 112.103 -174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 1.5 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.45000000000000001 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 1.8500000000000001 110.909 -173.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.51 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 3.48 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 3.27 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.4300000000000002 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 2.5899999999999999 107.706 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 1.6200000000000001 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 3.5499999999999998 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 1.5600000000000001 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.8999999999999999 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.5700000000000003 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 3.8700000000000001 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 1.8600000000000001 105.07 177.688 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 1.5800000000000001 104.551 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 2.25 105.204 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.6200000000000001 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.6200000000000001 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 3.5 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.2999999999999998 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 1.71 111.699 -176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 3.6000000000000001 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 1.49 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.0800000000000001 110.592 174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 1.78 109.394 175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.9399999999999999 110.509 -174.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 1.3400000000000001 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 1.7 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 1.8899999999999999 111.207 175.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.8899999999999999 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 4.5700000000000003 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 1.8799999999999999 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.46999999999999997 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 3.4900000000000002 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 3.0800000000000001 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 3.4399999999999999 111.457 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 4.2599999999999998 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.1200000000000001 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -134.14 62.14 1.66 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.0199999999999996 109.032 164.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -58.5 155.52 12.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.021 -1.072 . . . . 7.5700000000000003 109.197 160.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -160.5 -59.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.073 -1.421 . . . . 6.0899999999999999 108.345 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 62.74 -178.86 0.14 Allowed 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.013 0.82 . . . . 3.5699999999999998 110.479 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.189 1.796 . . . . 9.25 112.596 -172.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.382 0.512 . . . . 4.9199999999999999 112.382 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -129.5 -146.8 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.729 -1.349 . . . . 2.1499999999999999 109.729 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.8 158.7 26.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 106.472 -1.677 . . . . 2.1800000000000002 106.472 170.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.23 129.49 50.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 3.2799999999999998 106.901 171.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 3.25 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 2.75 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.62 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 3.54 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 2.8599999999999999 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.7999999999999998 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.3600000000000001 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 3.0499999999999998 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.70999999999999996 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 1.5600000000000001 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 1.4199999999999999 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45000000000000001 108.695 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 1.6200000000000001 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 4.1200000000000001 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 4.1100000000000003 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 1.72 108.906 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.1200000000000001 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.8999999999999999 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 1.54 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 2.7799999999999998 111.242 170.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 2.4199999999999999 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.4199999999999999 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 1.6899999999999999 112.606 -169.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 1.8899999999999999 111.011 -176.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.44 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 1.6899999999999999 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.51 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 3.48 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 3.1000000000000001 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.2599999999999998 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 2.6499999999999999 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 1.71 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 3.3599999999999999 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 1.6399999999999999 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.98 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.4699999999999998 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 3.4900000000000002 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 1.8999999999999999 105.734 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 1.8500000000000001 105.324 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 2.1000000000000001 106.05 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.9199999999999999 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 1.4199999999999999 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.7400000000000002 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 3.5499999999999998 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.4300000000000002 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 1.5900000000000001 110.773 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 3.3300000000000001 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 1.75 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.4100000000000001 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.477 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 1.6200000000000001 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.8100000000000001 109.915 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.5 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 1.6599999999999999 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 2.04 110.643 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.8799999999999999 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 3.6400000000000001 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 1.8899999999999999 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.59999999999999998 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 3.2799999999999998 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 2.0600000000000001 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 2.6400000000000001 112.876 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 4.0899999999999999 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.432 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.1899999999999999 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -129.49 60.96 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.8599999999999999 109.34 161.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -54.67 170.62 0.16 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.296 1.046 . . . . 7.54 111.503 158.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 49.6 40.19 18.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 113.825 -1.534 . . . . 4.5899999999999999 111.473 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 133.3 54.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 123.245 0.618 . . . . 6.4900000000000002 109.707 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 . . . . . 0 C--O 1.249 1.066 0 N-CA-C 106.935 -1.506 . . . . 7.6299999999999999 106.935 165.386 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.3 m . . . . . 0 C--O 1.227 -0.081 0 N-CA-C 110.149 -0.315 . . . . 5.6799999999999997 110.149 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.11 173.84 38.35 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.285 -1.126 . . . . 1.8899999999999999 110.285 170.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.8 m -143.02 113.45 7.35 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 121.47 -1.018 . . . . 2.1099999999999999 108.583 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 115.95 28.44 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 3.5899999999999999 106.854 177.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 3.3700000000000001 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 2.3599999999999999 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.68000000000000005 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 3.4300000000000002 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.6299999999999999 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 2.5099999999999998 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.4299999999999999 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 3.6499999999999999 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.59999999999999998 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 1.48 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 1.6100000000000001 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45000000000000001 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 1.27 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 4.2699999999999996 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 3.4500000000000002 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 1.72 109.862 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.2599999999999998 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.7599999999999998 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 1.8799999999999999 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 2.75 110.333 171.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 2.2999999999999998 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 1.02 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 1.6399999999999999 111.966 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 1.74 110.569 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.38 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 1.54 111.467 -172.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.4399999999999999 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 3.0099999999999998 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 3.21 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.6099999999999999 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 2.6600000000000001 108.526 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 1.5700000000000001 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 3.1600000000000001 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 1.5800000000000001 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 1.9099999999999999 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.1200000000000001 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 3.0899999999999999 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 2.0 107.01 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 1.7 106.842 177.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 2.1400000000000001 105.769 -173.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 1.46 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 3.4900000000000002 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.3500000000000001 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 1.6799999999999999 112.985 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.6000000000000001 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 1.74 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.3799999999999999 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 1.6899999999999999 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.2400000000000002 109.654 -171.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 1.5800000000000001 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 1.6799999999999999 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 1.71 109.404 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 5.8200000000000003 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 3.5499999999999998 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 1.79 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54000000000000004 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 3.1600000000000001 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.7400000000000002 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 2.8300000000000001 111.239 168.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 6.6299999999999999 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -132.42 56.97 1.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.4500000000000002 107.859 172.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.96 155.08 37.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.061 -1.024 . . . . 8.3900000000000006 108.625 168.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.24 94.34 0.06 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.639 1.575 . . . . 4.6699999999999999 111.883 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.1 -46.69 5.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 114.92 1.452 . . . . 4.5499999999999998 114.92 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.258 1.5 0 N-CA-C 103.156 -2.905 . . . . 7.7400000000000002 103.156 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 112.414 0.524 . . . . 4.46 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 160.06 -164.47 34.32 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 107.047 -2.421 . . . . 2.25 107.047 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -122.74 129.83 52.21 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 106.097 -1.816 . . . . 2.2599999999999998 106.097 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -97.47 127.41 43.4 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 3.9100000000000001 106.887 169.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 3.6699999999999999 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 2.4199999999999999 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.52 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.45000000000000001 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 2.6699999999999999 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.5600000000000001 112.917 -166.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.8599999999999999 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.5600000000000001 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 3.8300000000000001 112.936 -175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.4099999999999999 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82999999999999996 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 2.0 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 1.73 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.71999999999999997 108.655 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 1.6299999999999999 111.643 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 5.21 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.9700000000000002 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 1.7 108.566 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.3599999999999999 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.0800000000000001 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 1.77 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 2.9100000000000001 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 3.04 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.95999999999999996 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 1.73 112.571 -172.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 1.46 111.308 -176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 1.79 111.371 -173.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 1.1499999999999999 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 2.6499999999999999 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 3.4500000000000002 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.8700000000000001 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 3.5800000000000001 108.177 176.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 1.96 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 3.3999999999999999 110.502 172.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 1.72 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 2.1899999999999999 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.4900000000000002 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 3.2200000000000002 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 2.21 106.229 174.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 1.6100000000000001 104.867 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 2.1200000000000001 106.403 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.4500000000000002 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 1.6799999999999999 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.6400000000000001 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 3.5600000000000001 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 1.6599999999999999 112.675 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 3.3900000000000001 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 1.9399999999999999 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.1499999999999999 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.44 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 1.6000000000000001 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.0099999999999998 110.073 -174.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 1.76 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 1.53 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 1.8400000000000001 110.635 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.8600000000000001 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.9399999999999999 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 1.47 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52000000000000002 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 3.1499999999999999 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.9199999999999999 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 2.8999999999999999 113.246 172.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 4.6900000000000004 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.2300000000000004 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -111.2 60.54 0.61 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 59.48 -171.93 0.12 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.0 0.37 . . . . 4.8399999999999999 112.0 169.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -124.23 56.13 1.27 Allowed 'General case' 0 C--N 1.34 0.174 0 O-C-N 121.171 -0.956 . . . . 2.5099999999999998 109.626 -173.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 63.46 69.29 0.57 Allowed 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.419 1.088 . . . . 2.73 109.141 -169.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 . . . . . 0 C--O 1.258 1.501 0 CA-C-O 116.843 -1.551 . . . . 6.4800000000000004 108.22 -158.67 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 106.452 -1.685 . . . . 7.0599999999999996 106.452 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.9 164.1 11.32 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 107.264 -2.334 . . . . 3.4300000000000002 107.264 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.6 m -132.57 122.22 24.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.465 -1.309 . . . . 2.8500000000000001 107.465 174.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -98.09 109.55 22.29 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 3.6099999999999999 106.934 176.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.517 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 3.5 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.517 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.44 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 2.4100000000000001 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.6000000000000001 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 2.6200000000000001 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.3400000000000001 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.9399999999999999 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.57999999999999996 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 1.52 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 1.6499999999999999 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51000000000000001 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 1.46 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 4.8600000000000003 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 3.3199999999999998 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 1.9199999999999999 109.649 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.0600000000000001 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.0299999999999998 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 1.8100000000000001 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 3.1699999999999999 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.71 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 1.1299999999999999 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 1.74 112.045 -170.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 1.4399999999999999 110.721 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.42999999999999999 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 1.6599999999999999 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.24 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 2.9199999999999999 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 3.04 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.1499999999999999 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 2.7200000000000002 108.586 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 1.77 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 3.3799999999999999 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 1.5600000000000001 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 1.97 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.1100000000000003 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.8500000000000001 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 2.2999999999999998 106.008 173.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 1.6699999999999999 106.626 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 2.0 107.356 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.1200000000000001 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 1.4299999999999999 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.2200000000000002 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 40.0 t30 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 3.3300000000000001 102.759 172.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.44 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 1.6499999999999999 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 3.3799999999999999 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 2.04 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 1.6599999999999999 109.841 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.0899999999999999 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.3899999999999999 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 1.6599999999999999 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 1.79 110.183 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.9099999999999999 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 3.6299999999999999 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 1.6799999999999999 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.48999999999999999 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 3.2799999999999998 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 2.3500000000000001 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 3.48 112.567 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.9900000000000002 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.1100000000000003 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -111.42 60.9 0.61 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.3900000000000001 108.542 167.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 56.5 mm-40 60.66 -178.79 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.002 0.921 . . . . 3.8500000000000001 112.263 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.27 83.4 1.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.535 1.134 . . . . 2.9900000000000002 108.463 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 73.79 52.2 0.11 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 2.7400000000000002 113.498 171.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 107.139 -1.43 . . . . 7.0199999999999996 107.139 156.038 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.956 -0.387 . . . . 4.3399999999999999 109.956 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.85 -104.54 1.61 Allowed Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.417 -1.873 . . . . 2.5600000000000001 108.417 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 88.2 m -142.07 132.73 25.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.058 -1.26 . . . . 2.3900000000000001 108.734 165.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.516 HH21 ' C ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -96.33 115.52 27.56 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 4.8499999999999996 106.314 174.066 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 3.4100000000000001 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 2.6600000000000001 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.566 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.76000000000000001 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 2.21 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 3.2599999999999998 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 2.29 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 6.46 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.68000000000000005 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 1.6000000000000001 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 1.9099999999999999 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66000000000000003 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 1.3400000000000001 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.9500000000000002 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 3.3999999999999999 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 2.2200000000000002 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.0699999999999998 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.7599999999999998 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 1.6599999999999999 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 2.9300000000000002 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 2.3900000000000001 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.1599999999999999 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 1.95 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 1.8400000000000001 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.48999999999999999 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 1.8999999999999999 110.98 -173.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 1.1200000000000001 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 3.5 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 2.9100000000000001 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 3.6400000000000001 108.118 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 1.5900000000000001 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 3.1600000000000001 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 1.6100000000000001 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 3.3799999999999999 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.0199999999999996 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.9500000000000002 110.949 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 2.1000000000000001 104.109 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 1.47 107.087 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 1.8600000000000001 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 1.8100000000000001 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.6099999999999999 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 3.4399999999999999 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.5099999999999998 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 2.0099999999999998 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.5600000000000001 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 1.7 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.5600000000000001 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.474 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 2.04 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.8900000000000001 107.799 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.6899999999999999 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 1.9399999999999999 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 1.8799999999999999 110.017 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.7800000000000002 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 4.4000000000000004 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.8999999999999999 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.29 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 3.8399999999999999 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 2.48 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 2.79 110.524 165.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 5.3200000000000003 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7000000000000002 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.25 62.08 7.27 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.1200000000000001 108.647 168.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 61.96 173.44 0.13 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.998 1.719 . . . . 3.8799999999999999 114.392 168.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.72 52.02 2.22 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.403 -1.271 . . . . 2.6600000000000001 109.731 173.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 155.09 165.67 0.01 OUTLIER 'General case' 0 C--N 1.339 0.112 0 C-N-CA 127.667 2.387 . . . . 4.2000000000000002 108.934 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.516 ' C ' HH21 ' A' ' 5' ' ' ARG . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.424 0 C-N-CA 130.707 3.603 . . . . 10.890000000000001 101.438 -153.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 110.088 -0.338 . . . . 5.21 110.088 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 65.55 -168.88 30.44 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 108.958 -1.657 . . . . 2.2400000000000002 108.958 -163.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.78 169.52 16.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.149 -2.537 . . . . 2.3700000000000001 104.149 148.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -129.86 135.14 48.04 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 3.2400000000000002 105.544 163.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.548 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 3.3599999999999999 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 2.8199999999999998 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.548 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.48999999999999999 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 2.6699999999999999 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 2.7999999999999998 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 3.7400000000000002 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.3100000000000001 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.98 113.072 -174.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.3700000000000001 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 1.48 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 1.46 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51000000000000001 109.128 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 1.8500000000000001 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.8600000000000003 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 5.0499999999999998 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 1.8 108.981 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.3300000000000001 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.8900000000000001 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 1.54 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 3.3700000000000001 111.071 171.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.77 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.83999999999999997 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 1.74 111.561 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 1.6699999999999999 110.877 -175.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.32000000000000001 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 1.71 111.459 -174.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.54 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 2.7999999999999998 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 3.5099999999999998 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.4700000000000002 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 4.0 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 1.6499999999999999 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 3.1899999999999999 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 1.6699999999999999 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.72 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2000000000000002 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.9500000000000002 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 2.29 105.048 -178.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 1.74 104.73 -179.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 1.8 106.798 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.0800000000000001 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 1.7 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.6099999999999999 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 3.5899999999999999 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.0899999999999999 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 1.6699999999999999 110.904 -174.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.8399999999999999 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 1.73 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.8500000000000001 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 1.6899999999999999 110.141 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.9199999999999999 108.816 -173.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.9099999999999999 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 1.75 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 1.8200000000000001 111.756 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 2.0899999999999999 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 4.6100000000000003 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 1.49 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.56999999999999995 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 3.1499999999999999 109.265 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 2.4500000000000002 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 3.2999999999999998 111.218 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 5.71 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.1600000000000001 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -121.76 58.77 1.0 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.8500000000000001 108.582 170.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 58.31 -173.54 0.09 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.265 0.555 . . . . 3.8399999999999999 111.067 177.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.13 69.23 1.48 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.549 0.739 . . . . 2.6899999999999999 109.693 -173.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.65 116.39 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.297 1.439 . . . . 2.7799999999999998 111.804 -172.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 C--O 1.254 1.302 0 CA-C-O 116.758 -1.591 . . . . 6.7000000000000002 108.699 -169.186 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 109.259 -0.645 . . . . 5.9000000000000004 109.259 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -175.93 -177.71 45.17 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 107.922 -2.071 . . . . 2.3399999999999999 107.922 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 49.9 m -113.29 122.56 47.79 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 125.072 1.349 . . . . 2.6600000000000001 108.678 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.28 133.85 41.35 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 124.052 0.845 . . . . 3.7000000000000002 108.963 162.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.562 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 3.5 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 2.6800000000000002 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.562 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.44 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 2.8199999999999998 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.5299999999999998 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 2.4900000000000002 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.4199999999999999 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.71 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.4199999999999999 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64000000000000001 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 1.45 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 1.55 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 1.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 4.0999999999999996 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 3.7999999999999998 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 2.0600000000000001 110.467 -172.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.8300000000000001 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.5899999999999999 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 1.6599999999999999 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 2.96 110.606 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 4.4900000000000002 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 1.0800000000000001 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 1.5600000000000001 112.273 -167.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 1.3500000000000001 110.631 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.39000000000000001 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 1.71 112.258 -169.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.4299999999999999 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 3.2000000000000002 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 3.0800000000000001 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.3500000000000001 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 2.75 108.697 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 1.8200000000000001 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 3.23 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 1.5800000000000001 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 2.1600000000000001 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.2699999999999996 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 3.23 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 1.9399999999999999 105.3 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 1.6499999999999999 105.942 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 1.8400000000000001 106.477 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.8300000000000001 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.6200000000000001 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 3.6499999999999999 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.3199999999999998 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 1.55 113.635 176.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 3.3999999999999999 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 1.6699999999999999 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.1899999999999999 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.418 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 1.55 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 1.51 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 1.6200000000000001 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 1.8700000000000001 110.218 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.8600000000000001 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 4.1799999999999997 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 1.5600000000000001 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.47999999999999998 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 3.1499999999999999 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 2.0600000000000001 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 2.75 113.019 171.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.8900000000000001 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.0699999999999998 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -120.99 56.43 1.01 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.5099999999999998 110.821 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 70.01 147.92 0.07 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.293 1.837 . . . . 3.79 112.398 166.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -77.98 71.45 4.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.289 -0.869 . . . . 2.8999999999999999 109.378 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 75.19 89.24 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.721 1.208 . . . . 2.77 111.538 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 . . . . . 0 C--O 1.257 1.488 0 N-CA-C 106.429 -1.693 . . . . 7.4699999999999998 106.429 166.258 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.753 0.311 . . . . 5.1500000000000004 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.4 -167.26 17.45 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.25 -1.94 . . . . 2.9500000000000002 108.25 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.3 m -113.17 104.53 12.44 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 105.421 -2.066 . . . . 2.1400000000000001 105.421 -163.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.24 111.95 23.96 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 3.8799999999999999 106.502 -172.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.526 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 3.2999999999999998 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.9399999999999999 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.526 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.46999999999999997 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 2.4199999999999999 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.9399999999999999 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 3.8999999999999999 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.7400000000000002 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 3.1699999999999999 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.5600000000000001 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.73999999999999999 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 1.78 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 1.54 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 1.7 111.042 175.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 4.1799999999999997 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 4.5599999999999996 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 1.75 108.423 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.8500000000000001 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 3.4900000000000002 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 1.5800000000000001 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 2.8999999999999999 110.039 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 5.0 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 1.03 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 1.9199999999999999 112.226 -171.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 1.55 109.501 178.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65000000000000002 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 1.79 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 1.27 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 3.71 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 3.5099999999999998 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.2999999999999998 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 3.5299999999999998 107.742 174.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 1.8500000000000001 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 3.2999999999999998 110.527 172.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 1.73 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 2.0 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.1200000000000001 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.7999999999999998 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 2.0499999999999998 104.231 178.48 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 1.72 105.226 178.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 1.6899999999999999 106.203 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.3700000000000001 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.72 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.8399999999999999 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 5.0 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.2799999999999998 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 1.6399999999999999 114.412 178.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 3.2799999999999998 112.617 173.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 1.8899999999999999 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.0099999999999998 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 1.6399999999999999 109.728 -174.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.1099999999999999 109.892 -176.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 1.3999999999999999 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 1.52 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 1.8 110.423 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.8600000000000001 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.8399999999999999 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 1.47 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51000000000000001 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 3.2400000000000002 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 2.23 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 3.4399999999999999 112.941 179.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 5.1299999999999999 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.8700000000000001 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -117.67 61.22 0.76 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.9299999999999999 109.574 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 66.28 174.14 0.24 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 122.802 1.287 . . . . 5.9199999999999999 111.742 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -126.51 103.11 7.42 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 105.474 -2.047 . . . . 2.7799999999999998 105.474 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.9 124.23 24.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.149 -1.056 . . . . 4.8600000000000003 108.149 171.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 128.569 2.748 . . . . 11.24 104.388 -175.67 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 109.555 -0.535 . . . . 4.5800000000000001 109.555 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.55 -128.36 0.4 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.682 -0.967 . . . . 1.9199999999999999 110.682 -170.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 m -144.47 123.01 12.44 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.76 -1.57 . . . . 1.99 106.76 168.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.79 106.76 18.68 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 4.5700000000000003 103.846 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.55 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 3.3900000000000001 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 2.3300000000000001 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.55 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.69999999999999996 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 2.52 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 3.77 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 2.5299999999999998 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.5700000000000001 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 3.0299999999999998 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76000000000000001 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 1.51 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 1.73 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 1.48 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 4.3700000000000001 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 4.6299999999999999 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 1.9299999999999999 110.001 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.8200000000000001 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.0699999999999998 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 1.6599999999999999 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 3.1800000000000002 111.167 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 2.4199999999999999 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 1.03 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 1.78 112.586 -171.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 1.79 110.782 -177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.44 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 1.5800000000000001 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.4299999999999999 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 2.7799999999999998 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 3.4199999999999999 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.8899999999999999 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 3.8100000000000001 107.839 175.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 1.78 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 3.2400000000000002 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 1.6899999999999999 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 2.0800000000000001 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.3900000000000001 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 3.0800000000000001 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.416 ' CD2' HD21 ' A' ' 60' ' ' LEU 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 2.1200000000000001 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 1.6200000000000001 105.571 -178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 1.9199999999999999 108.047 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.2599999999999998 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 1.5 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.5099999999999998 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 3.6499999999999999 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.1299999999999999 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 1.5900000000000001 111.758 173.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.75 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 1.8400000000000001 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.4500000000000002 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 1.7 109.613 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.0699999999999998 109.689 -168.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 1.45 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 1.8200000000000001 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 1.9399999999999999 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.8500000000000001 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 4.4199999999999999 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 1.45 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.46000000000000002 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 3.6499999999999999 110.152 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 2.4500000000000002 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 2.73 114.74 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 5.4199999999999999 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.9700000000000002 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.73 51.45 2.13 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.4199999999999999 108.634 169.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 63.8 147.86 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.086 2.555 . . . . 3.6600000000000001 115.227 167.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.43 74.96 9.28 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 114.303 -1.317 . . . . 2.9700000000000002 108.954 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.83 -152.06 0.37 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.757 1.223 . . . . 2.73 111.156 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 128.461 2.705 . . . . 6.3099999999999996 104.033 173.827 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.508 0.194 . . . . 5.4699999999999998 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.52 -149.5 20.38 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.546 -2.621 . . . . 1.9299999999999999 106.546 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -141.39 127.4 19.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.477 1.139 . . . . 1.8200000000000001 108.264 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -96.74 102.94 14.81 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 3.21 107.479 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.489 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 3.25 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 3.0299999999999998 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.489 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.69999999999999996 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 4.1900000000000004 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.71 109.851 -178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.71 106.113 169.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.3999999999999999 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.8500000000000001 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76000000000000001 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 1.5800000000000001 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 1.6100000000000001 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.46999999999999997 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 1.3500000000000001 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 5.6699999999999999 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 3.8500000000000001 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 1.5900000000000001 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.1499999999999999 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.6699999999999999 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 1.6799999999999999 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 3.3300000000000001 110.728 175.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 3.54 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.85999999999999999 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 1.77 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 1.3700000000000001 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.46000000000000002 113.455 -171.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 1.7 110.927 -177.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 1.1699999999999999 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 2.6400000000000001 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 3.5800000000000001 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.2200000000000002 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 2.6899999999999999 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 2.0800000000000001 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 3.4300000000000002 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 1.6000000000000001 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.8400000000000001 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.7799999999999998 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 3.8599999999999999 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 1.8300000000000001 104.818 173.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 1.6899999999999999 106.237 176.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 2.0299999999999998 107.25 -171.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.3100000000000001 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 1.6399999999999999 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.1400000000000001 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 5.0499999999999998 103.797 -170.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.5299999999999998 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 1.8300000000000001 113.378 -172.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 3.6600000000000001 111.061 -170.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 1.9399999999999999 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7000000000000002 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.412 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 1.6299999999999999 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.71 107.886 -174.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 1.5600000000000001 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 1.6599999999999999 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 1.75 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.98 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 6.3899999999999997 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 2.0499999999999998 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77000000000000002 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 3.27 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 2.6000000000000001 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 3.3599999999999999 113.345 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.96 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.409 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.5899999999999999 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -103.81 70.61 1.02 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.8500000000000001 109.109 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.1 mp0 61.58 -179.07 0.12 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.513 1.149 . . . . 4.9400000000000004 110.789 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -125.43 76.78 1.59 Allowed 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.648 -0.871 . . . . 3.3900000000000001 108.648 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.04 87.52 0.11 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.294 1.038 . . . . 3.0600000000000001 112.358 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 116.876 -1.535 . . . . 7.3200000000000003 109.802 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 106.223 -1.769 . . . . 5.9299999999999997 106.223 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.38 141.91 11.33 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 108.734 -1.746 . . . . 2.4300000000000002 108.734 -169.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.37 127.03 27.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.787 -1.931 . . . . 2.7999999999999998 105.787 173.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -97.77 147.44 24.38 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.474 1.109 . . . . 3.4900000000000002 108.044 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.485 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 3.46 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 2.6299999999999999 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.485 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.52000000000000002 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 3.1200000000000001 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 3.2000000000000002 109.944 -172.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 3.6299999999999999 108.925 169.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.1200000000000001 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 3.0699999999999998 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.59999999999999998 110.457 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 1.47 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 1.6200000000000001 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.46999999999999997 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 1.23 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 6.1399999999999997 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 3.5099999999999998 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 1.6599999999999999 108.333 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.8199999999999998 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 1.8500000000000001 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 2.8799999999999999 110.671 170.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 2.23 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 1.1399999999999999 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 1.6399999999999999 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 1.46 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.47999999999999998 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 1.71 110.932 -171.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 1.21 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 3.4900000000000002 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 3.4399999999999999 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 2.6899999999999999 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 1.9399999999999999 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 3.2400000000000002 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 1.5700000000000001 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 2.0899999999999999 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.3500000000000001 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 3.23 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 2.0699999999999998 106.003 177.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 1.78 103.516 -178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 2.1600000000000001 105.018 -176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.3799999999999999 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 1.6799999999999999 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.3900000000000001 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 5.0599999999999996 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.3700000000000001 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 1.8 111.827 -171.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.6899999999999999 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 1.8500000000000001 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.9300000000000002 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 1.6499999999999999 108.849 176.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.6899999999999999 111.265 -173.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.6699999999999999 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 1.72 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 1.8799999999999999 110.872 175.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.8500000000000001 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 3.4100000000000001 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 1.55 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.58999999999999997 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 3.3300000000000001 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 3.3199999999999998 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 2.75 113.674 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.8900000000000001 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.5800000000000001 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.76 61.45 1.67 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.5299999999999998 110.511 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.6 152.91 44.37 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 120.462 -1.399 . . . . 7.4500000000000002 110.835 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -165.83 -54.06 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.351 1.061 . . . . 6.7300000000000004 108.822 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.81 -70.68 0.14 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.038 1.335 . . . . 4.6500000000000004 111.462 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 C--O 1.247 0.923 0 N-CA-C 108.046 -1.094 . . . . 8.5800000000000001 108.046 158.229 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 120.595 0.236 . . . . 4.75 110.429 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.11 -176.58 41.43 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 109.873 -1.291 . . . . 2.1499999999999999 109.873 166.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -125.93 118.02 24.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.542 1.537 . . . . 2.3900000000000001 107.853 -177.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -96.88 133.05 42.01 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 3.6000000000000001 107.765 173.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.557 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 3.8700000000000001 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 3.1000000000000001 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.557 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.42999999999999999 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 3.1600000000000001 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 2.5899999999999999 113.754 -171.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.8900000000000001 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.4299999999999999 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 4.0700000000000003 112.896 -163.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.1799999999999999 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66000000000000003 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 1.55 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 1.6499999999999999 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.48999999999999999 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 1.3600000000000001 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 6.2400000000000002 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 5.2999999999999998 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 1.55 109.045 178.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.8999999999999999 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.7200000000000002 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 1.5900000000000001 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 2.9900000000000002 111.536 172.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.6800000000000002 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 1.1100000000000001 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 1.6200000000000001 112.115 -169.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 1.6899999999999999 110.645 -178.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.40999999999999998 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 1.8500000000000001 112.117 -169.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.3899999999999999 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 3.0099999999999998 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 3.3500000000000001 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 3.6699999999999999 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 1.72 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 3.2000000000000002 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 1.5600000000000001 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.98 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.3600000000000003 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 4.25 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 1.79 104.916 174.495 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 1.75 103.666 179.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 2.1499999999999999 106.537 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.1299999999999999 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.7 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.5699999999999998 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 3.5299999999999998 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.1600000000000001 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 1.6699999999999999 113.473 176.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 3.6200000000000001 112.64 179.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 1.8500000000000001 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.0699999999999998 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 1.54 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.1499999999999999 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 1.4199999999999999 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 1.49 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 1.71 110.116 175.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.8899999999999999 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 4.8099999999999996 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 1.72 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55000000000000004 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 3.1899999999999999 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 2.3300000000000001 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 3.3300000000000001 113.112 174.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 5.5199999999999996 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.7200000000000002 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -125.41 59.35 1.26 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.6299999999999999 110.009 166.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 64.01 168.58 0.16 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.947 1.699 . . . . 5.0099999999999998 113.449 173.216 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.36 71.67 1.38 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.127 -1.397 . . . . 2.8199999999999998 108.838 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 64.99 102.21 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.031 0.932 . . . . 2.5600000000000001 113.353 -176.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 . . . . . 0 C--O 1.257 1.449 0 CA-C-O 116.464 -1.731 . . . . 7.7199999999999998 106.452 138.312 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 105.825 -1.917 . . . . 6.2400000000000002 105.825 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -151.89 -87.24 0.06 OUTLIER Glycine 0 CA--C 1.522 0.519 0 N-CA-C 109.067 -1.613 . . . . 2.6600000000000001 109.067 -176.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.0 m -144.35 150.82 38.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 105.974 -1.862 . . . . 2.29 105.974 161.046 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -104.28 121.91 44.31 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 4.6399999999999997 107.076 166.711 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.607 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 3.6000000000000001 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 2.73 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.607 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.81000000000000005 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 3.0299999999999998 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 4.1900000000000004 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.52 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.6200000000000001 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 8.4600000000000009 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.8100000000000001 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 2.0 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 1.8700000000000001 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.3600000000000001 107.023 173.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 1.3999999999999999 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 7.7699999999999996 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 4.1399999999999997 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 1.73 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.8400000000000001 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 3.54 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 1.73 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 3.2200000000000002 111.139 175.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 2.2999999999999998 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 1.0900000000000001 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 1.8300000000000001 112.121 -170.086 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 1.9399999999999999 109.8 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.69999999999999996 114.33 -177.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 1.5700000000000001 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.72 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 3.7200000000000002 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 3.2200000000000002 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.8400000000000001 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 3.5099999999999998 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 1.8200000000000001 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 3.1800000000000002 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 1.6799999999999999 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.98 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.6699999999999999 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 3.48 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 1.97 105.629 177.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 1.8600000000000001 106.58 171.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 1.9099999999999999 108.401 171.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 1.8300000000000001 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.2999999999999998 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 4.5199999999999996 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.4700000000000002 111.457 171.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 1.8100000000000001 112.675 -174.154 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.5699999999999998 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 1.6000000000000001 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.1099999999999999 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 1.6699999999999999 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.8599999999999999 109.045 -166.584 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 2.79 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 1.5 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 1.97 110.912 176.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.8500000000000001 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 4.3300000000000001 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 1.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55000000000000004 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 3.3900000000000001 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.99 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 2.7400000000000002 113.212 176.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 7.5199999999999996 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.7400000000000002 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -120.42 57.76 0.94 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.9299999999999999 109.547 165.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 64.73 -178.58 0.17 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 126.81 2.044 . . . . 3.96 112.352 162.133 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.8 68.7 1.16 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.152 -1.425 . . . . 2.98 107.152 -167.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.89 -63.05 0.44 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.725 0.81 . . . . 3.0 110.394 -167.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--O 1.25 1.08 0 N-CA-C 106.611 -1.626 . . . . 7.0899999999999999 106.611 164.025 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 110.659 -0.126 . . . . 6.9000000000000004 110.659 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.75 -95.72 0.05 OUTLIER Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.968 -0.853 . . . . 2.54 110.968 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.1 m -144.13 126.51 15.8 Favored 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 121.168 -1.195 . . . . 1.9299999999999999 109.638 165.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.6 127.11 40.32 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 4.21 108.614 169.203 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.563 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 3.21 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 2.4100000000000001 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.563 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.62 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 2.5499999999999998 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 2.6200000000000001 112.02 -161.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 2.8100000000000001 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.3100000000000001 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 3.3399999999999999 112.643 -166.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.4199999999999999 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.65000000000000002 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 1.6100000000000001 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 1.52 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 1.8400000000000001 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.9699999999999998 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.8999999999999999 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 1.8300000000000001 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6000000000000001 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 1.6899999999999999 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 2.79 110.945 174.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 2.3900000000000001 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.84999999999999998 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 1.96 112.359 -170.249 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 1.8300000000000001 110.789 -176.345 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.46000000000000002 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 1.7 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.51 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 2.8300000000000001 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 3.9500000000000002 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.6599999999999999 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 2.8999999999999999 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 1.9199999999999999 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 3.1800000000000002 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.6100000000000001 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 3.3199999999999998 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 4.1900000000000004 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 1.99 103.609 168.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 1.52 103.775 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 1.7 106.971 -177.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.1200000000000001 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 1.55 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.3599999999999999 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 3.6899999999999999 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.1099999999999999 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 1.6100000000000001 108.672 173.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 3.96 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 1.8400000000000001 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.1699999999999999 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 1.6599999999999999 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.6499999999999999 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.46 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 1.6499999999999999 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 1.9299999999999999 110.322 173.501 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.8400000000000001 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 3.4700000000000002 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 1.6100000000000001 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.60999999999999999 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 3.25 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.8300000000000001 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 2.8900000000000001 113.763 172.764 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 4.0499999999999998 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -123.49 57.24 1.17 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.3500000000000001 108.948 167.089 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 60.46 -178.8 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 122.881 1.324 . . . . 5.3399999999999999 111.532 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -122.65 120.27 33.21 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 102.654 -3.091 . . . . 2.8399999999999999 102.654 174.445 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -46.09 76.34 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.455 -0.498 . . . . 3.4900000000000002 110.27 -178.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.669 1.187 . . . . 10.609999999999999 110.302 -175.664 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.23 0.075 0 N-CA-C 110.164 -0.31 . . . . 6.4800000000000004 110.164 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.67 -167.3 22.33 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.718 -0.953 . . . . 3.0299999999999998 110.718 173.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.5 m -96.16 115.06 26.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 106.277 -1.749 . . . . 2.7000000000000002 106.277 173.27 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.28 131.17 40.16 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 3.79 106.429 169.218 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.51 ' CB ' ' CZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 3.3300000000000001 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 2.5 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.51 ' CZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.56000000000000005 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 3.2000000000000002 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 2.7000000000000002 109.559 -168.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 3.6099999999999999 108.076 -175.596 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.6200000000000001 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.9199999999999999 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.4099999999999999 115.156 -176.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68000000000000005 109.338 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 1.6200000000000001 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 1.7 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.47999999999999998 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 1.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 5.54 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 3.8900000000000001 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 2.0699999999999998 109.629 178.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.6299999999999999 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 1.8899999999999999 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 3.1299999999999999 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 2.4500000000000002 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.3500000000000001 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 1.6200000000000001 112.186 -170.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 1.53 109.317 176.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51000000000000001 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 1.6799999999999999 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.9399999999999999 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 2.5699999999999998 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 3.0 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 2.71 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 1.75 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 3.2200000000000002 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 1.72 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 1.8899999999999999 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.8200000000000003 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 4.0999999999999996 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 1.8100000000000001 105.774 169.984 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 1.6699999999999999 106.192 172.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 1.8500000000000001 106.464 -177.151 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.8900000000000001 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 1.74 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.7200000000000002 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 4.8799999999999999 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.2400000000000002 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 1.76 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 3.3999999999999999 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 1.98 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.0499999999999998 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.434 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 1.6499999999999999 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 3.0499999999999998 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 1.55 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 1.8300000000000001 110.527 175.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.9199999999999999 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 4.7999999999999998 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 1.53 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.59999999999999998 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 3.04 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 2.1899999999999999 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 2.7999999999999998 112.646 172.497 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 5.75 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.8799999999999999 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -116.18 54.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.1899999999999999 108.194 163.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 58.15 172.39 0.06 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.661 1.985 . . . . 3.8700000000000001 113.664 174.456 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.68 73.02 1.58 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.252 -1.018 . . . . 2.6899999999999999 108.252 178.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 58.17 83.24 0.12 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.738 1.384 . . . . 2.79 114.738 -177.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 107.481 -1.303 . . . . 7.3899999999999997 107.481 130.715 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 119.12 -0.467 . . . . 5.46 110.581 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.83 144.69 45.6 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.824 -0.91 . . . . 2.3100000000000001 110.824 178.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.62 108.14 20.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.434 -1.321 . . . . 2.1200000000000001 107.434 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.04 128.26 37.81 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 3.7000000000000002 105.983 175.051 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 3.3500000000000001 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 3.0899999999999999 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.496 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.58999999999999997 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 2.5299999999999998 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 3.7000000000000002 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 2.5699999999999998 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 3.2599999999999998 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65000000000000002 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 1.77 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 1.6499999999999999 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52000000000000002 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 1.5900000000000001 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 5.7400000000000002 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 3.75 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 1.76 110.106 178.377 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.8400000000000001 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 3.8100000000000001 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 1.71 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 2.8100000000000001 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 2.4100000000000001 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.71 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 1.5800000000000001 111.647 -173.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 1.5600000000000001 110.607 177.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45000000000000001 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 2.0299999999999998 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.9199999999999999 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 3.52 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 2.9100000000000001 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.0099999999999998 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 2.6899999999999999 109.44 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 1.55 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 3.27 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 1.8100000000000001 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 1.8 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.8300000000000001 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.96 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 2.2000000000000002 106.228 170.278 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 1.72 106.814 170.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 1.8300000000000001 106.403 -178.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.6299999999999999 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.8200000000000001 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.8399999999999999 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 3.73 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.4399999999999999 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 2.0 113.16 -173.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.54 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 1.7 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.04 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.435 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 2.1499999999999999 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 68' ' ' ARG . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.6600000000000001 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.6200000000000001 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 1.8200000000000001 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 1.8 109.621 175.541 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.3700000000000001 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 4.4500000000000002 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 1.8300000000000001 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.71999999999999997 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 3.73 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.8400000000000001 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 2.6400000000000001 112.197 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 57' ' ' GLU . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 7.5999999999999996 107.031 168.67 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.6699999999999999 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -85.68 62.53 7.52 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.9299999999999999 109.926 168.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 69.73 143.54 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.313 1.445 . . . . 3.8199999999999998 112.391 168.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -80.58 67.0 6.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.278 -0.874 . . . . 3.3100000000000001 110.115 -177.134 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 80.37 96.37 0.05 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.578 1.151 . . . . 3.1099999999999999 112.132 -176.599 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.402 0 N-CA-C 102.704 -3.073 . . . . 6.6699999999999999 102.704 155.308 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 107.318 -1.364 . . . . 4.54 107.318 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -143.49 1.68 Allowed Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.56 -1.416 . . . . 2.1699999999999999 109.56 168.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.7 m -143.69 135.27 26.17 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 120.559 -1.554 . . . . 2.4399999999999999 107.376 170.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 113.37 25.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 4.2199999999999998 106.078 -173.642 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 3.2000000000000002 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 2.3399999999999999 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.483 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.78000000000000003 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 4.3700000000000001 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.8700000000000001 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 2.7599999999999998 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.3799999999999999 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 3.6600000000000001 111.288 -178.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.5600000000000001 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65000000000000002 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 1.8500000000000001 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 1.52 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 1.52 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.9300000000000002 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 4.6500000000000004 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 1.6799999999999999 109.349 179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.0899999999999999 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 1.71 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 3.3300000000000001 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 4.5 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.79000000000000004 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 1.73 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 1.8400000000000001 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.44 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 1.6499999999999999 111.695 -171.019 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.4199999999999999 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 2.8999999999999999 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 3.4700000000000002 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.9399999999999999 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 3.0800000000000001 110.198 -175.224 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 1.78 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 3.2799999999999998 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 1.6399999999999999 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 1.8400000000000001 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.0599999999999996 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 3.6800000000000002 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 2.02 105.876 171.686 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 1.6599999999999999 105.791 175.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 2.0699999999999998 108.415 171.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.1299999999999999 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.75 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.8399999999999999 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.431 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 3.1099999999999999 106.426 152.0 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.431 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.5899999999999999 107.537 -177.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 1.8899999999999999 111.681 -175.913 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.8399999999999999 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 1.8899999999999999 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.1600000000000001 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 1.6499999999999999 109.829 -179.561 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.0699999999999998 109.687 -174.433 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.6799999999999999 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 1.6200000000000001 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 1.8 109.648 172.809 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 6.1900000000000004 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 5.75 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 1.8600000000000001 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.83999999999999997 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 3.1000000000000001 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 2.23 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 3.2799999999999998 111.653 179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 6.4400000000000004 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.4900000000000002 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.81 55.33 1.72 Allowed 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.3999999999999999 110.964 170.169 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 58.85 -178.32 0.08 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 122.458 1.123 . . . . 4.9800000000000004 112.438 174.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -130.48 96.59 4.17 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.259 1.024 . . . . 2.8500000000000001 108.977 -179.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 56.35 43.4 26.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.014 1.326 . . . . 3.0 111.228 176.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--O 1.262 1.717 0 N-CA-C 103.77 -2.678 . . . . 7.9500000000000002 103.77 165.87 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.384 -0.598 . . . . 6.6200000000000001 109.384 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.01 -168.35 37.2 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.279 0.942 . . . . 3.3900000000000001 111.482 170.247 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.74 113.86 25.54 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 105.767 -1.938 . . . . 2.5899999999999999 105.767 -166.612 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.35 140.92 29.03 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 3.6699999999999999 106.814 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.522 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 3.2200000000000002 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 2.6000000000000001 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.522 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.46000000000000002 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 3.0 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.6699999999999999 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 3.3900000000000001 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 3.3300000000000001 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.5600000000000001 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.83999999999999997 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 1.9299999999999999 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 1.8 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66000000000000003 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 1.48 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 5.54 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 4.0899999999999999 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 1.5900000000000001 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.0600000000000001 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 3.3300000000000001 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 1.55 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 3.2400000000000002 111.23 174.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 2.25 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 2.2599999999999998 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 1.8400000000000001 111.512 -164.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 1.6100000000000001 110.401 178.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.47999999999999998 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 1.79 111.477 -178.323 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.74 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.9500000000000002 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 3.6099999999999999 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.6200000000000001 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 2.5899999999999999 107.1 178.028 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 1.78 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 3.25 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 1.8500000000000001 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 2.2400000000000002 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.1500000000000004 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 4.1600000000000001 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 2.0299999999999998 105.531 172.043 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 1.6799999999999999 101.934 -179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 2.2400000000000002 106.024 171.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.3500000000000001 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 1.8 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.3799999999999999 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 3.6899999999999999 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.1299999999999999 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 1.8100000000000001 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 3.5499999999999998 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 1.5 110.34 174.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.6499999999999999 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 1.8400000000000001 109.312 177.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 1.78 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 1.7 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 1.6399999999999999 109.925 174.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.8799999999999999 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 4.8499999999999996 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 1.51 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45000000000000001 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 3.25 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 2.1699999999999999 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 2.5600000000000001 112.495 173.14 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 7.8099999999999996 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -123.04 51.22 1.46 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.3300000000000001 108.028 170.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 55.63 -179.56 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.738 1.256 . . . . 3.7599999999999998 111.825 -177.063 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.72 55.09 1.27 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.803 0.841 . . . . 2.6600000000000001 109.561 -167.106 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 75.95 139.43 0.07 Allowed 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 124.76 1.288 . . . . 2.8500000000000001 109.332 -157.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.222 -1.37 . . . . 7.4699999999999998 107.589 167.994 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 109.659 -0.496 . . . . 4.2199999999999998 109.659 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.03 -168.6 13.22 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.486 -0.645 . . . . 2.0899999999999999 111.486 172.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.47 119.14 31.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.738 -1.578 . . . . 2.5299999999999998 106.738 -173.433 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.54 125.96 43.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 4.0300000000000002 107.865 -176.683 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.544 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 3.3900000000000001 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 2.73 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.544 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.58999999999999997 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 2.8399999999999999 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 4.0700000000000003 110.345 -169.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 3.0 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.1299999999999999 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 3.02 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.8100000000000001 114.13 -161.143 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.69999999999999996 108.381 -172.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 1.51 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 1.52 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.56999999999999995 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 1.5700000000000001 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 5.3099999999999996 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.7300000000000004 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 1.6299999999999999 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.4199999999999999 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.8599999999999999 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 1.51 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 3.23 111.388 173.063 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 2.3599999999999999 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.88 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 1.75 112.075 -173.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 1.45 109.995 -179.23 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.53000000000000003 113.372 -177.037 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 1.6299999999999999 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.6499999999999999 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 3.9300000000000002 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 3.3100000000000001 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.8300000000000001 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 2.7000000000000002 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 1.6200000000000001 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 3.3300000000000001 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 1.5600000000000001 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 2.0 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.8399999999999999 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 3.0800000000000001 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 2.04 106.043 173.164 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 1.6699999999999999 103.391 177.284 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 2.0099999999999998 106.586 175.078 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.1400000000000001 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 1.6000000000000001 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 4.8700000000000001 103.208 -163.931 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.1800000000000002 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 1.9199999999999999 113.181 -169.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.6200000000000001 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 1.6000000000000001 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.8900000000000001 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 1.8200000000000001 109.551 178.416 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.0099999999999998 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 2.2000000000000002 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 1.6200000000000001 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 1.8 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.98 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 6.4199999999999999 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 1.71 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.66000000000000003 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 3.1899999999999999 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 2.6899999999999999 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 3.4500000000000002 114.421 175.331 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 5.25 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.418 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.4199999999999999 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -118.51 56.55 0.88 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.4900000000000002 110.391 175.112 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 66.62 -179.45 0.21 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.592 1.157 . . . . 3.71 111.479 165.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -106.17 64.87 0.68 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.941 0.896 . . . . 3.0099999999999998 108.859 175.351 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 60.22 54.21 4.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.889 0.876 . . . . 3.1600000000000001 111.773 -177.243 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.255 1.382 0 N-CA-C 104.819 -2.289 . . . . 7.9500000000000002 104.819 171.548 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 5.3499999999999996 108.73 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 2.3700000000000001 107.697 -175.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 2.1699999999999999 107.035 173.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 3.2000000000000002 106.995 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.472 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 3.2599999999999998 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 2.7599999999999998 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.472 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.53000000000000003 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 2.48 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 3.6499999999999999 108.579 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 3.4900000000000002 106.182 148.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.4399999999999999 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 3.6699999999999999 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66000000000000003 109.147 -168.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 1.55 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 1.4099999999999999 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51000000000000001 108.977 172.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 1.23 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.9900000000000002 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 3.8100000000000001 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 2.04 109.51 176.33 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.0299999999999998 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.75 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 2.0499999999999998 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 2.9900000000000002 111.061 175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.6400000000000001 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.24 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 1.7 112.148 -172.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 1.4099999999999999 111.394 -173.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.46000000000000002 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 1.6899999999999999 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.96 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.96 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 3.6499999999999999 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 3.6099999999999999 107.371 175.174 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 2.0299999999999998 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 3.25 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 1.71 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 2.2999999999999998 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1000000000000001 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 3.8100000000000001 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 2.0699999999999998 105.385 167.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 1.8200000000000001 103.196 173.73 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 2.1699999999999999 106.324 166.319 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.1800000000000002 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 1.6499999999999999 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.1699999999999999 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 3.5699999999999998 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.3500000000000001 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 1.6000000000000001 111.698 -174.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 3.1200000000000001 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 1.8700000000000001 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.7799999999999998 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 1.6699999999999999 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.7200000000000002 109.555 -174.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 1.47 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 1.48 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 1.8200000000000001 110.582 174.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.8700000000000001 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 3.6699999999999999 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 1.6799999999999999 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.57999999999999996 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 3.2999999999999998 109.999 177.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 3.3399999999999999 110.545 -169.537 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 2.7799999999999998 115.015 -174.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 4.9900000000000002 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.7599999999999998 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.1600000000000001 109.194 172.635 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.7799999999999998 112.76 175.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 2.8799999999999999 107.077 174.166 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.6800000000000002 111.751 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.8300000000000001 102.189 151.753 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 5.3499999999999996 108.73 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 2.3700000000000001 107.697 -175.751 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 2.1699999999999999 107.035 173.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 3.2000000000000002 106.995 179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.472 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 3.2599999999999998 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 2.7599999999999998 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.472 ' CZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.53000000000000003 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 2.48 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 3.6499999999999999 108.579 -178.829 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 3.4900000000000002 106.182 148.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.4399999999999999 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 3.6699999999999999 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66000000000000003 109.147 -168.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 1.55 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 1.4099999999999999 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51000000000000001 108.977 172.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 1.23 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.9900000000000002 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 3.8100000000000001 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 2.04 109.51 176.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.0299999999999998 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.75 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 2.0499999999999998 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 2.9900000000000002 111.061 175.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.6400000000000001 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.24 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 1.7 112.148 -172.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 1.4099999999999999 111.394 -173.525 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.46000000000000002 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 1.6899999999999999 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.96 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.96 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 3.6499999999999999 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 3.6099999999999999 107.371 175.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 2.0299999999999998 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 3.25 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 1.71 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 2.2999999999999998 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1000000000000001 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 3.8100000000000001 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 2.0699999999999998 105.385 167.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 1.8200000000000001 103.196 173.73 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 2.1699999999999999 106.324 166.319 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.1800000000000002 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 1.6499999999999999 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.1699999999999999 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 3.5699999999999998 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.3500000000000001 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 1.6000000000000001 111.698 -174.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 3.1200000000000001 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 1.8700000000000001 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.7799999999999998 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 1.6699999999999999 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.7200000000000002 109.555 -174.568 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 1.47 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 1.48 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 1.8200000000000001 110.582 174.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.8700000000000001 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 3.6699999999999999 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 1.6799999999999999 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.57999999999999996 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 3.2999999999999998 109.999 177.786 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 3.3399999999999999 110.545 -169.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 2.7799999999999998 115.015 -174.683 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 4.9900000000000002 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.7599999999999998 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.1600000000000001 109.194 172.635 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.7799999999999998 112.76 175.142 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 2.8799999999999999 107.077 174.166 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.6800000000000002 111.751 179.168 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.8300000000000001 102.189 151.753 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 2.59 107.123 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.85 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 1.85 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 1.7 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.85 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.47 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 1.7 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG11 ' SD ' ' A' ' 13' ' ' MET . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.21 113.224 -161.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 1.73 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.41 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.479 ' SD ' HG21 ' A' ' 22' ' ' VAL . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 2.17 111.152 -177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.41 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 0.33 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 0.25 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.554 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56 108.087 172.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 0.31 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 5.74 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 2.87 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 0.54 108.247 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.06 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.7 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 0.57 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.426 ' CG1' HG13 ' A' ' 56' ' ' VAL . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 1.92 109.865 175.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 3.71 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.17 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 0.57 112.092 -170.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 0.36 110.641 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.32 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.452 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 0.36 111.979 -175.58 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.04 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 1.77 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 2.43 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.88 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 1.84 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 0.56 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 1.98 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 0.55 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 0.92 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.1 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.05 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 0.76 106.792 170.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.662 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 0.44 105.168 174.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.539 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 0.59 107.635 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.82 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 0.83 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.53 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 2.5 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.05 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 0.45 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 7.77 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' ' CG ' ' A' ' 57' ' ' GLU . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 0.81 111.792 173.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.22 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.727 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 0.34 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.559 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.67 108.451 -167.453 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 1.52 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 0.41 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.697 HD22 HD13 ' A' ' 67' ' ' LEU . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 0.42 110.965 176.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.49 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 2.98 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 0.65 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.53 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 1.86 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.34 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.697 HD13 HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 1.91 110.999 168.321 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 3.45 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.4 110.622 170.816 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? . . . . . 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 3.34 106.052 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.806 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 2.05 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 1.99 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.806 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.27 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 1.72 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 11' ' ' SER . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 1.92 110.128 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 10' ' ' VAL . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.1 105.533 169.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.08 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.08 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 1.65 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 0.99 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 0.45 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.07 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 0.6 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 4.23 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.33 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 0.43 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.83 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 2.87 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 0.57 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.516 HG13 HG22 ' A' ' 56' ' ' VAL . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 2.27 111.016 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.27 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.21 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 0.87 111.836 -171.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 0.6 109.722 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.57 113.477 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 0.42 111.802 -169.321 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.19 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 1.62 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 2.68 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 1.79 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 1.89 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 3.33 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 1.72 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.47 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.18 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.15 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 0.88 106.644 176.476 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.8 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 0.4 105.288 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.929 HG23 HD11 ' A' ' 44' ' ' LEU . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 0.71 107.236 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.43 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.504 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 0.86 112.086 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.49 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 3.29 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.417 ' O ' HG23 ' A' ' 52' ' ' ILE . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.85 111.05 166.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 0.43 112.181 -174.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 2.38 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 0.5 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.57 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.644 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 0.36 108.772 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HB2' HD11 ' A' ' 67' ' ' LEU . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.06 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 0.35 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' HD23 ' A' ' 67' ' ' LEU . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 0.39 111.012 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.5 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.03 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 0.52 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 1.91 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 1.5 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 2.08 111.889 -178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.33 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.83 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? . . . . . 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 2.79 109.163 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.74 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 1.97 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 1.52 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.74 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.38 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 1.97 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 2.52 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.21 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.22 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 2.22 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.39 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.7 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 0.36 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 0.26 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.44 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 0.3 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.26 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 3.87 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 60' ' ' LEU . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 0.45 109.946 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.11 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.87 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 0.45 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.95 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 1.7 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.79 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 0.44 112.013 -171.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 0.4 109.737 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 0.3 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 0.91 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 2.56 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 2.07 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.92 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 1.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 0.6 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 1.98 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 0.72 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 0.95 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.12 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 2.77 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 0.75 107.503 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 0.42 106.233 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.594 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 0.61 107.397 -174.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.14 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 0.85 109.058 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.64 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 3.52 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.44 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 0.37 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 2.62 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 0.4 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.89 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.615 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 0.33 109.616 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.582 ' HA ' HD21 ' A' ' 67' ' ' LEU . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.42 108.691 -169.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 1.96 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 0.31 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 0.47 110.737 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.31 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 4.42 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 0.51 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 1.94 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 1.86 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 2.1 111.401 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 3.49 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.39 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 2.4 107.452 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.794 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 2.11 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 1.8 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.794 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.31 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 2.22 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 12' ' ' GLY . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 2.45 111.135 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.23 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 10' ' ' VAL . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.05 105.306 175.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.26 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.69 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 0.36 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 0.28 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.47 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 0.39 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 5.16 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 2.62 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 0.55 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.83 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.66 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 0.62 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 2.11 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 1.91 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.07 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 0.6 110.938 -171.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 0.49 109.143 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.55 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.412 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 0.39 112.045 -172.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 0.99 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 1.73 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 2.66 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.63 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 1.76 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 0.55 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 1.81 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 0.61 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 1.2 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.53 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 3.13 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.782 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 0.8 104.894 172.164 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.746 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 0.39 105.313 172.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.782 HG23 HD11 ' A' ' 44' ' ' LEU . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 0.7 107.633 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.66 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.616 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 0.79 110.494 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.41 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 3.56 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.03 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.426 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 0.46 112.722 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 2.88 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 0.46 111.176 172.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.86 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.738 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 0.38 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.557 ' HB2' HD11 ' A' ' 67' ' ' LEU . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.41 110.233 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.01 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 0.42 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.554 ' CD2' HD23 ' A' ' 67' ' ' LEU . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 0.46 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.44 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 2.9 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 0.72 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.51 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 2.05 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 1.64 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' ' 57' ' ' GLU . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 2.02 113.02 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 3.54 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.61 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7 109.622 164.288 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 3.36 107.624 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.674 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 2.42 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 1.49 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.674 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.45 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 2.76 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 2.63 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 1.72 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.41 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 2.11 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.19 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.71 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 0.4 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 0.25 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.49 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 0.34 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 3.77 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 3.14 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.478 HG13 HD11 ' A' ' 60' ' ' LEU . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 0.4 109.345 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.67 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.11 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 0.45 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 2.16 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.04 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.7 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 0.41 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 0.38 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.32 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 0.37 112.061 -169.46 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 0.99 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 2.11 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 2.21 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.87 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.838 HG12 HD13 ' A' ' 44' ' ' LEU . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 1.55 106.58 171.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 0.76 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 1.85 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 0.9 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 0.98 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.47 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 3.45 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD13 HG12 ' A' ' 37' ' ' VAL . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 0.71 104.312 172.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.633 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 0.31 103.189 -176.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 52' ' ' ILE . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 0.71 107.398 176.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.443 ' HB3' ' CE2' ' A' ' 6' ' ' TYR . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 0.72 111.023 -172.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.37 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 2.53 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.35 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.558 HD11 HG11 ' A' ' 46' ' ' VAL . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 0.5 111.382 -175.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.41 109.771 -164.127 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 0.49 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.68 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.658 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 0.39 109.116 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.06 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 0.38 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 HD23 ' A' ' 67' ' ' LEU . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 0.43 110.423 174.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.49 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 2.91 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 0.57 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 1.99 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 1.61 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 2.08 114.132 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 4.26 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.81 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.41 108.14 162.363 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 2.68 106.268 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.757 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 1.91 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 1.69 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.37 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 4.06 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 1.93 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 2.43 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.08 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.269 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.269 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 0.35 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 0.25 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 0.24 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.12 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 2.42 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 0.47 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.36 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 0.44 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CG2' HG13 ' A' ' 56' ' ' VAL . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 2.08 111.112 170.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 1.81 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.09 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 0.5 111.45 -173.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 0.39 110.382 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.35 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 0.35 112.286 -173.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.15 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 1.81 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 2.5 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.63 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 2.92 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 0.57 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 1.94 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 0.59 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 0.97 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.02 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 2.79 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 45' ' ' VAL 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 0.86 104.448 -176.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.512 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 0.3 104.61 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.434 HG11 HD11 ' A' ' 52' ' ' ILE . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 0.72 107.246 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.4 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 0.67 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.34 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 2.43 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.16 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.434 HD11 HG11 ' A' ' 46' ' ' VAL . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 0.38 111.729 -177.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.34 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 0.69 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.78 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.725 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 0.43 109.932 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.685 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1 109.544 -172.292 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 0.92 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 0.37 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 0.54 110.365 176.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.46 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 2.86 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 0.47 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 1.86 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 1.39 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.685 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 1.68 112.6 176.521 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.09 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.8 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.34 110.217 177.693 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 2.87 105.172 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.836 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 1.99 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 1.54 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.836 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.41 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 1.61 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.436 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.11 112.542 -163.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.05 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.512 ' SD ' HG21 ' A' ' 22' ' ' VAL . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.14 112.299 -170.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 0.39 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 0.37 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 0.37 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 3.39 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 2.43 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' CYS . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 0.42 108.684 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.9 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 0.44 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.595 HG13 HG22 ' A' ' 56' ' ' VAL . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 2.24 111.434 176.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.05 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.86 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 0.59 111.548 -172.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 0.44 111.175 -177.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.42 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 0.36 111.319 -175.015 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.31 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 2.07 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 2.11 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.49 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.529 HG12 HD13 ' A' ' 44' ' ' LEU . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 1.56 109.302 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 0.59 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 1.84 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 0.63 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.03 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.64 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 2.26 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.884 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 0.55 105.123 172.975 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.706 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 0.43 106.499 173.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.884 HG23 HD11 ' A' ' 44' ' ' LEU . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 0.73 108.457 178.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.31 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.56 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 2.64 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.87 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.502 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 0.41 111.298 175.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 3.57 111.775 -176.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 0.49 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 0.37 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.742 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.43 110.482 -175.54 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 0.92 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 0.31 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 0.45 110.212 174.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.49 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.01 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 0.48 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 22' ' ' VAL . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 1.89 110.942 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 2.91 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 1.86 113.609 174.914 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.29 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.57 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.36 110.2 171.702 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 2.39 107.457 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.704 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 1.94 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 1.71 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.704 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.44 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 1.79 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.12 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.0 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.36 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 2.22 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.61 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 0.35 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 0.33 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.535 ' O ' HG23 ' A' ' 22' ' ' VAL . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.49 109.046 172.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 0.26 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 3.85 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 2.37 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 18' ' ' CYS . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 0.55 109.838 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.85 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 2.82 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 0.48 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.771 HG22 HG11 ' A' ' 32' ' ' VAL . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 2.57 110.679 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 1.94 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 0.92 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 1.16 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 0.59 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.453 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.48 113.269 -170.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.771 HG11 HG22 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 0.35 110.841 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 0.95 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 1.99 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 2.13 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.62 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.749 HG12 HD13 ' A' ' 44' ' ' LEU . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 1.64 106.412 173.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 0.55 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 1.94 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 0.52 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 0.97 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.61 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 2.87 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 0.65 105.429 175.024 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.781 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 0.37 103.065 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.595 HG23 HD11 ' A' ' 44' ' ' LEU . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 0.85 107.292 171.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.12 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 0.92 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.5 p30 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 3.26 104.312 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 0.62 113.932 -177.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 2.78 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.443 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 0.44 111.011 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.24 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 26' ' ' VAL . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 0.67 108.582 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 1.09 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 0.33 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 67' ' ' LEU . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 0.49 110.633 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.49 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 2.69 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 0.45 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.43 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 2.0 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 2.62 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 60' ' ' LEU 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 1.72 113.563 179.934 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 3.27 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.72 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 3.3 107.607 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.594 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 2.19 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 1.48 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.742 ' CE3' HG11 ' A' ' 56' ' ' VAL . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.47 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 2.8 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 2.66 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.07 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.43 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.01 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.257 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.59 113.649 -174.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.257 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.74 108.96 -168.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 0.44 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 0.26 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 0.3 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 3.62 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 2.58 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.735 HG13 HD11 ' A' ' 60' ' ' LEU . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 0.4 110.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.86 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 2.37 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 0.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 56' ' ' VAL . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 1.86 111.201 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 3.97 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 0.95 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 55' ' ' GLN . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 0.64 112.103 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 0.52 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.38 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.438 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 0.46 110.909 -173.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.17 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 2.27 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 2.14 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.43 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.662 HG12 HD13 ' A' ' 44' ' ' LEU . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 1.68 107.706 175.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 0.53 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 2.18 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 0.54 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.15 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.57 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 2.7 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.762 HD12 ' N ' ' A' ' 45' ' ' VAL 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 0.59 105.07 177.688 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.762 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 0.29 104.551 -179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 0.99 105.204 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.03 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.62 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 2.42 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.3 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.605 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 0.48 111.699 -176.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 2.8 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 0.43 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB3' HD13 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.08 110.592 174.366 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.742 HG11 ' CE3' ' A' ' 8' ' ' TRP . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 0.44 109.394 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 67' ' ' LEU . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.94 110.509 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 0.84 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 0.47 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.735 HD11 HG13 ' A' ' 22' ' ' VAL . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 0.49 111.207 175.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.61 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 3.61 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 0.58 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.47 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 2.1 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 2.12 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.591 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 2.02 111.457 -178.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 3.44 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.413 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.12 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.02 109.032 164.675 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 2.37 106.901 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 1.9 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 1.89 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.37 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 2.62 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 1.82 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.02 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.36 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 2.12 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.71 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 0.41 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 0.28 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45 108.695 172.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 0.34 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 3.44 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 3.21 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 18' ' ' CYS . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 0.43 108.906 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.12 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.9 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 0.41 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.457 ' CG1' HG13 ' A' ' 56' ' ' VAL . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 1.87 111.242 170.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 1.83 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.27 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 0.46 112.606 -169.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 0.49 111.011 -176.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.37 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 0.45 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.08 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 2.32 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 1.98 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.26 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 1.68 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 0.52 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 2.01 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 0.7 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.3 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.47 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 2.63 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 0.81 105.734 175.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 0.59 105.324 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.492 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 0.81 106.05 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.92 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 0.72 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.74 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 2.48 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.43 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.492 HD11 HG11 ' A' ' 46' ' ' VAL . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 0.42 110.773 -178.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 2.65 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 0.61 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.41 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.775 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 0.35 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.439 ' HB2' HD21 ' A' ' 67' ' ' LEU . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.81 109.915 -176.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.13 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 0.4 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.622 HD22 HD13 ' A' ' 67' ' ' LEU . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 0.52 110.643 176.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.53 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 2.86 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 0.6 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.6 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 1.97 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 1.43 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.622 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 1.59 112.876 175.502 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 3.33 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.19 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.86 109.34 161.756 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 2.68 106.854 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.756 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 2.09 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 1.59 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.44 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 2.41 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.06 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 1.75 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.43 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 2.54 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.6 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 0.34 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 0.27 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 0.25 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 3.54 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 2.57 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 HD11 ' A' ' 60' ' ' LEU . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 0.55 109.862 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.26 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.76 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 0.55 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.465 ' CG1' HG13 ' A' ' 56' ' ' VAL . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 1.8 110.333 171.201 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 1.73 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 0.81 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 0.4 111.966 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 0.39 110.569 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.35 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 0.35 111.467 -172.489 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.09 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 1.99 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 2.07 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.61 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 44' ' ' LEU . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 1.69 108.526 174.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 0.51 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 1.81 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 0.57 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 0.98 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.12 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 2.31 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 0.72 107.01 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.653 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 0.41 106.842 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.566 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 0.82 105.769 -173.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 0.73 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 2.45 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.35 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 0.49 112.985 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.07 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 0.57 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.38 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.678 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 0.37 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HB2' HD21 ' A' ' 67' ' ' LEU . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.24 109.654 -171.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 0.87 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 0.48 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.658 HD22 HD13 ' A' ' 67' ' ' LEU . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 0.48 109.404 175.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 4.16 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 2.76 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 0.55 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 1.87 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.2 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.658 HD13 HD22 ' A' ' 60' ' ' LEU 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 1.77 111.239 168.417 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 5.59 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.45 107.859 172.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 2.85 106.887 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.756 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 2.38 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 1.58 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.38 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 1.67 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HE3' ' A' ' 13' ' ' MET . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.09 112.917 -166.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.1 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.56 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.554 ' HE3' HG21 ' A' ' 10' ' ' VAL . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 2.6 112.936 -175.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.41 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 0.55 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 0.38 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.464 ' O ' HG23 ' A' ' 22' ' ' VAL . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.72 108.655 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 0.32 111.643 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 3.88 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.09 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HE2' ' A' ' 13' ' ' MET . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 0.4 108.566 175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.36 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.08 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 0.54 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 1.95 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 2.25 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.85 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 0.44 112.571 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 0.38 111.308 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.446 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 0.43 111.371 -173.121 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 0.93 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 1.7 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 2.34 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.87 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.579 HG22 HD13 ' A' ' 44' ' ' LEU . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 2.33 108.177 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 0.69 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 2.03 110.502 172.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 0.54 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 1.09 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.49 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 2.35 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 0.78 106.229 174.796 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.72 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 0.3 104.867 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.67 HG23 HD11 ' A' ' 44' ' ' LEU . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 0.88 106.403 -179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.45 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 0.7 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.64 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 2.5 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.402 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 0.48 112.675 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 2.92 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 0.57 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.15 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.668 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 0.32 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.01 110.073 -174.681 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 0.92 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 0.32 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.456 HD11 HG13 ' A' ' 22' ' ' VAL . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 0.56 110.635 176.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.46 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.28 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 0.46 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 1.86 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.54 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 57' ' ' GLU 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 1.72 113.246 172.826 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 3.96 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.23 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 2.62 106.934 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.868 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 2.2 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 1.42 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.868 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.29 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 1.65 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.04 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 1.8 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.34 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.07 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.58 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 0.37 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 0.38 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 0.36 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 3.54 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 2.45 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 60' ' ' LEU . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 0.7 109.649 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.06 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.03 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 0.54 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 2.01 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.03 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 0.89 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 0.55 112.045 -170.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 0.4 110.721 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.39 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 0.35 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.04 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 1.99 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 1.94 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.15 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.735 HG12 HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 1.81 108.586 -179.332 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 0.58 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 2.02 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 0.58 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 0.96 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.11 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.12 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 0.84 106.008 173.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.785 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 0.36 106.626 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.772 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 0.74 107.356 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.12 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 0.63 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.22 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 2.42 102.759 172.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 0.48 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 2.85 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 0.58 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.602 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 0.34 109.841 175.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.09 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.08 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 0.46 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 22' ' ' VAL . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 0.47 110.183 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.57 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 2.96 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 0.5 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.49 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 1.9 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 1.62 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 2.11 112.567 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.29 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.11 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 . . . . . 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.39 108.542 167.907 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 3.6 106.314 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 2.16 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 1.43 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.61 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 1.56 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 2.97 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 1.73 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 5.18 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.67 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 0.38 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 0.47 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 0.3 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.3 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 2.62 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 0.79 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.07 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.76 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 0.61 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 1.79 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 1.83 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.05 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 0.64 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 0.52 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.49 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 0.46 110.98 -173.554 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 0.96 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 2.32 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 1.84 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.611 HG22 HD13 ' A' ' 44' ' ' LEU . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 2.39 108.118 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 0.53 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 1.84 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 0.67 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 2.64 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.02 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.15 110.949 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.611 HD13 HG22 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 0.9 104.109 -175.902 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.582 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 0.29 107.087 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 0.62 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 0.7 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.61 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 2.54 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.51 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 0.83 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.24 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 0.55 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.56 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 0.85 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HA ' HD21 ' A' ' 67' ' ' LEU . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.89 107.799 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.14 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 0.91 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 0.76 110.017 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.78 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 3.64 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.31 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.16 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 2.52 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 1.86 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.623 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 1.82 110.524 165.241 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 4.4 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.12 108.647 168.702 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 2.37 105.544 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.795 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 2.01 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 1.59 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.795 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.39 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 1.86 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 1.81 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 2.77 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.31 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HG2' HG21 ' A' ' 22' ' ' VAL . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.23 113.072 -174.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.37 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 0.34 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 0.31 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.555 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51 109.128 172.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 0.28 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.07 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 4.13 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 0.55 108.981 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.33 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.89 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 0.44 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 56' ' ' VAL . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 2.16 111.071 171.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.09 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.82 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 0.55 111.561 -174.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 0.33 110.877 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.31 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 0.38 111.459 -174.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.19 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 1.81 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 2.36 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.47 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 2.85 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 0.52 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 1.84 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 0.55 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.3 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.14 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.57 HD12 ' N ' ' A' ' 45' ' ' VAL 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 0.92 105.048 -178.669 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.57 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 0.32 104.73 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 52' ' ' ILE . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 0.76 106.798 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.08 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 0.94 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.61 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 2.51 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.09 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.494 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 0.4 110.904 -174.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.37 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 0.63 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.85 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 0.4 110.141 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.535 ' HA ' HD21 ' A' ' 67' ' ' LEU . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.92 108.816 -173.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.25 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 0.44 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.431 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 0.59 111.756 178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 1.54 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 3.74 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 0.56 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.48 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.464 ' CE2' HG22 ' A' ' 22' ' ' VAL . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 1.84 109.265 174.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 1.66 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 2.01 111.218 -177.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 4.27 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.16 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.85 108.582 170.902 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 108.963 -0.754 . . . . 2.76 108.963 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.774 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 2.06 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 1.61 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.774 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.35 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 1.96 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.03 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 1.79 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.42 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.14 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.42 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 0.35 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 0.26 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 0.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 3.44 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 2.78 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.446 HG13 HD11 ' A' ' 60' ' ' LEU . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 0.68 110.467 -172.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.83 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.59 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 0.52 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 HG13 ' A' ' 56' ' ' VAL . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 1.82 110.606 170.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 3.26 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 0.89 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 0.44 112.273 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 0.35 110.631 -178.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.32 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 0.33 112.258 -169.297 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.06 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 2.4 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 1.97 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.35 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.653 HG12 HD13 ' A' ' 44' ' ' LEU . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 1.77 108.697 177.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 0.66 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 1.88 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 0.86 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 1.33 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.27 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 2.34 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 0.66 105.3 -179.613 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.671 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 0.4 105.942 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 0.68 106.477 -178.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.26 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.62 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 2.6 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.32 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.507 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 0.39 113.635 176.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 2.88 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 0.56 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.19 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.697 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 0.34 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.713 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 0.95 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 0.39 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 HD13 ' A' ' 67' ' ' LEU . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 0.61 110.218 173.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.48 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 3.49 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 0.54 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.45 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 1.85 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 1.37 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.713 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 1.86 113.019 171.131 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.22 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.07 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.51 110.821 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 2.95 106.502 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.83 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 2.05 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.15 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.83 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.37 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 1.66 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.01 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 2.96 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.74 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 2.47 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.56 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.74 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 0.55 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 0.35 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.609 ' O ' HG23 ' A' ' 22' ' ' VAL . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 0.38 111.042 175.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 3.42 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 3.59 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 18' ' ' CYS . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 0.51 108.423 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.85 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 2.75 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 0.52 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.46 ' CG1' HG13 ' A' ' 56' ' ' VAL . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 1.87 110.039 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 3.71 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 0.83 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 0.48 112.226 -171.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 0.53 109.501 178.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 0.48 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 0.98 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 2.65 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 2.43 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.3 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.694 HG22 HD13 ' A' ' 44' ' ' LEU . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 2.23 107.742 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 0.68 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 1.95 110.527 172.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 0.65 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 1.28 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.12 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.06 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.694 HD13 HG22 ' A' ' 37' ' ' VAL 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 0.77 104.231 178.48 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.67 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 0.32 105.226 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG11 HD11 ' A' ' 52' ' ' ILE . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 0.6 106.203 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.37 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.19 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.84 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 3.51 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.28 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.561 HD11 HG11 ' A' ' 46' ' ' VAL . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 0.47 114.412 178.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.442 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 2.7 112.617 173.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 0.81 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.01 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 0.33 109.728 -174.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.524 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.11 109.892 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 0.86 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 0.32 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.45 ' CD2' HD23 ' A' ' 67' ' ' LEU . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 0.5 110.423 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.48 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.11 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 0.49 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 1.86 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 1.55 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.525 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 2.07 112.941 179.164 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 4.32 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.87 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.93 109.574 170.339 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 3.44 103.846 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 2.15 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 1.58 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.36 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 1.64 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 2.49 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 1.85 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.57 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 2.58 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 0.35 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 0.31 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 0.47 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 3.7 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 3.66 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 18' ' ' CYS . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 0.51 110.001 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.82 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.07 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 0.41 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.541 ' CG2' HG13 ' A' ' 56' ' ' VAL . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 2.15 111.167 176.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 1.84 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 0.84 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 0.42 112.586 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 0.39 110.782 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.34 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 0.31 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.04 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 1.86 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 2.3 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.89 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.599 HG22 HD13 ' A' ' 44' ' ' LEU . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.55 107.839 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 0.6 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 1.92 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 0.71 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 1.43 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.39 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 2.28 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.599 HD13 HG22 ' A' ' 37' ' ' VAL 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 0.83 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.44 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 0.35 105.571 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 52' ' ' ILE . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 0.7 108.047 177.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.26 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 0.67 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.51 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 2.57 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.13 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.513 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 0.42 111.758 173.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.0 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 0.41 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.45 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.666 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 0.35 109.613 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.774 ' HB2' HD21 ' A' ' 67' ' ' LEU . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.07 109.689 -168.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 0.89 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 0.48 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 0.69 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.49 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 3.43 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 0.48 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.45 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.47 ' CE2' HG22 ' A' ' 22' ' ' VAL . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 2.24 110.152 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 1.67 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.774 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 1.83 114.74 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 4.09 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.97 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.42 108.634 169.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 2.4 107.479 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 1.9 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 1.86 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.717 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.43 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 2.99 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 11' ' ' SER . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.08 109.851 -178.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.437 ' H ' HG22 ' A' ' 10' ' ' VAL . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.15 106.113 169.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.4 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.16 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.42 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 0.26 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.47 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 0.31 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 4.74 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 2.92 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 0.38 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.15 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.67 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 0.43 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.431 HG13 HG22 ' A' ' 56' ' ' VAL . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 2.15 110.728 175.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 2.75 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.77 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 0.45 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 0.4 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.535 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.43 113.455 -171.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 0.54 110.927 -177.449 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 0.93 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 1.7 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 2.44 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.22 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 1.59 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 0.68 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 2.06 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 0.68 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.14 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.78 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 2.96 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 0.74 104.818 173.673 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.769 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 0.38 106.237 176.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.736 HG23 HD11 ' A' ' 44' ' ' LEU . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 0.78 107.25 -171.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.31 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 0.7 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.14 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 p30 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 3.63 103.797 -170.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.53 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.535 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 0.53 113.378 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.415 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 2.55 111.061 -170.772 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 0.58 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.717 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 0.4 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HG3' HD13 ' A' ' 67' ' ' LEU . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.44 107.886 -174.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 0.84 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 0.42 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 0.55 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.57 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 5.5 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 0.88 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 1.97 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 1.84 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 2.13 113.345 177.357 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.26 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.59 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.85 109.109 172.709 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.442 -0.857 0 N-CA-C 108.044 -1.095 . . . . 2.56 108.044 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.656 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 2.1 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 1.47 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.678 ' CE3' HG11 ' A' ' 56' ' ' VAL . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.38 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 2.13 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 11' ' ' SER . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 2.26 109.944 -172.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' HG22 ' A' ' 10' ' ' VAL . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 2.71 108.925 169.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.12 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 2.38 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.003 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.003 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.6 110.457 -171.254 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 0.34 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 0.31 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.47 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 0.25 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 5.26 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 2.65 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.439 HG13 HD11 ' A' ' 60' ' ' LEU . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 0.39 108.333 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.82 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 0.61 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG11 HG13 ' A' ' 56' ' ' VAL . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 1.97 110.671 170.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 1.67 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 0.92 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 0.53 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 0.53 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.37 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 0.48 110.932 -171.289 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 0.97 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 2.14 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 2.27 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 1.72 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 0.8 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 1.87 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 0.58 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 1.01 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.35 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 2.34 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 0.91 106.003 177.691 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 0.54 103.516 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.564 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 0.93 105.018 -176.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.38 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 0.89 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.39 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 3.66 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.37 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.452 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 0.59 111.827 -171.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.22 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 0.58 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.93 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' CE3' ' A' ' 8' ' ' TRP . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 0.44 108.849 176.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.827 ' HB2' HD21 ' A' ' 67' ' ' LEU . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.69 111.265 -173.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.31 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 0.48 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD22 HD13 ' A' ' 67' ' ' LEU . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 0.63 110.872 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.47 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 2.78 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 0.53 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.59 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 1.96 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 2.21 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 1.83 113.674 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.27 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.58 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.53 110.511 -169.247 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 2.64 107.765 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.906 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 2.51 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 1.95 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.906 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.28 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 2.16 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.484 HG21 ' HE3' ' A' ' 13' ' ' MET . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 1.83 113.754 -171.197 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.17 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.43 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.491 ' CE ' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 3.01 112.896 -163.314 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.18 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.38 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 0.34 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.49 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 0.34 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 4.63 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 4.07 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG11 ' CE ' ' A' ' 13' ' ' MET . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 0.38 109.045 178.863 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.9 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.72 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.47 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 56' ' ' VAL . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 1.87 111.536 172.426 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.01 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 0.88 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 0.44 112.115 -169.947 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 0.36 110.645 -178.15 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.35 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 0.35 112.117 -169.486 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.01 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 2.06 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 2.14 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 2.39 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 0.5 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 1.86 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 0.58 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.19 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.36 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 3.22 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 0.64 104.916 174.495 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 0.44 103.666 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.593 HG23 HD11 ' A' ' 44' ' ' LEU . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 0.86 106.537 -178.285 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.13 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.05 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.57 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 2.48 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.16 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.414 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 0.48 113.473 176.65 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 2.85 112.64 179.112 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 0.63 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.07 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.673 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 0.33 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.15 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 0.99 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 0.3 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.679 HD22 HD23 ' A' ' 67' ' ' LEU . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 0.45 110.116 175.93 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.55 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 3.79 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 0.77 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 1.87 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 1.6 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.679 HD23 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 2.13 113.112 174.28 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 4.56 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.72 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.63 110.009 166.787 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 3.54 107.076 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.882 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 2.24 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 1.65 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.882 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.58 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 1.96 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 3.06 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.4 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.01 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 7.49 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.81 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.099 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 0.85 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 0.83 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 1.099 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.36 107.023 173.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 0.52 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 6.31 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 3.33 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 0.53 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.84 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 2.79 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 0.52 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 56' ' ' VAL . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 2.15 111.139 175.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 1.73 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 0.88 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 0.64 112.121 -170.086 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 0.58 109.8 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.539 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.56 114.33 -177.246 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 0.35 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.18 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 2.62 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 2.24 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.84 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 2.21 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 0.5 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 1.85 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 0.66 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.18 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.67 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 2.61 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.7 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 0.72 105.629 177.573 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.7 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 0.43 106.58 171.836 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 0.71 108.401 171.333 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 0.75 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.3 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 3.09 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 52' ' ' ILE . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.47 111.457 171.674 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.539 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 0.52 112.675 -174.154 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.08 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.49 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.11 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.688 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 0.4 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HA ' HD21 ' A' ' 67' ' ' LEU 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.86 109.045 -166.584 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 1.86 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 0.33 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.811 HD22 HD13 ' A' ' 67' ' ' LEU . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 0.46 110.912 176.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.5 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 3.59 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 0.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 2.0 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.54 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.811 HD13 HD22 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 1.77 113.212 176.783 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 6.37 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.74 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.93 109.547 165.506 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 3.13 108.614 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.82 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 1.87 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 1.53 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.82 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.4 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 1.65 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 1.94 112.02 -161.213 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 1.87 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.31 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.425 ' SD ' HG11 ' A' ' 10' ' ' VAL . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 2.47 112.643 -166.972 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.42 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.62 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 0.41 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 0.31 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 0.33 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.13 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.08 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 0.43 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 0.45 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.431 ' CG1' HG13 ' A' ' 56' ' ' VAL . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 1.73 110.945 174.919 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 1.79 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.7 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 0.49 112.359 -170.249 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 0.5 110.789 -176.345 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.44 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 0.48 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.07 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 1.85 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 2.58 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.66 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 1.81 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 0.63 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 1.83 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.34 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 2.32 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 3.07 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD12 ' H ' ' A' ' 45' ' ' VAL . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 0.76 103.609 168.821 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.52 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 0.33 103.775 176.512 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.499 HG23 HD11 ' A' ' 44' ' ' LEU . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 0.6 106.971 -177.752 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.12 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 0.81 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.36 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 2.63 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.11 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.465 HD13 HG23 ' A' ' 56' ' ' VAL . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 0.42 108.672 173.133 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 2.88 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.63 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.17 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.752 HG11 ' HZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 0.38 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.65 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.06 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 0.39 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.685 HD22 HD13 ' A' ' 67' ' ' LEU . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 0.46 110.322 173.501 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.47 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 2.76 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 0.49 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.61 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 1.93 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.12 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.685 HD13 HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 1.77 113.763 172.764 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 3.45 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.35 108.948 167.089 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 2.83 106.429 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.772 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 2.08 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 1.68 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.772 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.47 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 2.09 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.559 HG22 ' H ' ' A' ' 11' ' ' SER . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 1.7 109.559 -168.021 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.559 ' H ' HG22 ' A' ' 10' ' ' VAL . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 2.8 108.076 -175.596 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.62 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.07 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.252 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.41 115.156 -176.465 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.252 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68 109.338 -167.58 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 0.37 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 0.3 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.48 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 0.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 3.97 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 2.9 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 60' ' ' LEU . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 0.64 109.629 178.684 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.63 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 0.78 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 2.16 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 1.86 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.13 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 0.47 112.186 -170.734 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 0.51 109.317 176.451 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 0.51 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.5 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 1.84 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 1.9 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 1.74 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 0.54 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 1.9 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 0.67 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 0.94 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.82 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 2.96 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 0.62 105.774 169.984 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.581 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 0.3 106.192 172.932 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 0.73 106.464 -177.151 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.89 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 0.93 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.72 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 3.4 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.24 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 0.54 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 2.93 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 0.62 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.05 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.752 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 0.38 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.898 ' HB2' HD21 ' A' ' 67' ' ' LEU . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 2.13 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 0.46 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 22' ' ' VAL . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 0.51 110.527 175.26 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.57 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 3.94 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 0.71 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.54 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 1.76 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 1.38 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 1.9 112.646 172.497 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 4.58 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.88 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 . . . . . 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.19 108.194 163.988 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 2.65 105.983 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.745 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 2.01 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 2.33 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.745 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.51 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 1.7 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 2.56 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 1.84 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 2.25 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 0.4 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 0.28 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 0.29 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 4.84 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 2.81 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 60' ' ' LEU . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 0.61 110.106 178.377 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.84 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 2.96 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 0.82 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 1.76 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 1.84 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.66 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 0.53 111.647 -173.419 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 0.52 110.607 177.606 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 0.56 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.61 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 2.37 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 1.84 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.01 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.741 HG12 HD13 ' A' ' 44' ' ' LEU . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 1.74 109.44 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 0.5 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 1.9 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 0.6 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 0.95 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.83 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.1 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.922 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 0.73 106.228 170.278 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 0.46 106.814 170.159 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.922 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 0.7 106.403 -178.767 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.63 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.03 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.84 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 2.77 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.44 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.41 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 0.83 113.16 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.15 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 0.61 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.01 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.688 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 0.73 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.615 ' HA ' HD21 ' A' ' 67' ' ' LEU . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.49 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.03 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 0.7 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 22' ' ' VAL . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 0.56 109.621 175.541 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.02 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 3.59 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 0.9 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.66 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 2.29 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.68 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.615 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 1.71 112.197 176.524 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 6.64 107.031 168.67 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.67 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 . . . . . 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.93 109.926 168.926 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.401 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 3.19 106.078 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 1.93 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 1.46 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.685 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.48 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 3.31 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.33 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 1.97 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.38 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.561 ' SD ' HG21 ' A' ' 22' ' ' VAL . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 2.58 111.288 -178.713 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.56 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 0.43 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 0.3 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 0.33 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.23 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 3.58 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.561 HG21 ' SD ' ' A' ' 13' ' ' MET . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 0.39 109.349 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.09 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 0.44 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 2.09 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 3.34 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.74 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 0.55 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 0.46 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.37 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 0.5 111.695 -171.019 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.09 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 1.98 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 2.48 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.94 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.415 HG12 HD13 ' A' ' 44' ' ' LEU . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 1.88 110.198 -175.224 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 0.6 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 1.9 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 0.72 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 0.96 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.06 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 2.77 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.755 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 1.0 105.876 171.686 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.755 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 0.28 105.791 175.855 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.552 HG11 HD11 ' A' ' 52' ' ' ILE . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 0.83 108.415 171.971 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.13 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.12 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.84 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 2.39 106.426 152.0 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.59 107.537 -177.91 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.59 HD13 HG23 ' A' ' 56' ' ' VAL . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 0.58 111.681 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.43 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 0.79 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.16 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.685 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 0.35 109.829 -179.561 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.598 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.07 109.687 -174.433 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.4 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 0.53 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.745 HD22 HD23 ' A' ' 67' ' ' LEU . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 0.57 109.648 172.809 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 4.49 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 4.76 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 0.84 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.74 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 1.78 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 1.78 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.745 HD23 HD22 ' A' ' 60' ' ' LEU . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 2.16 111.653 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 5.09 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.49 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.4 110.964 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 2.62 106.814 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.767 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 1.9 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 1.69 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.767 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.32 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 1.95 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.07 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 2.62 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 2.34 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.56 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.84 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 0.57 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 0.46 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 0.36 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 4.72 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 3.02 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 0.41 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.06 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 2.61 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 0.44 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.519 HG13 HG22 ' A' ' 56' ' ' VAL . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 2.02 111.23 174.684 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 1.69 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 1.34 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 0.54 111.512 -164.382 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 0.52 110.401 178.243 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.48 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 0.42 111.477 -178.323 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.28 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.36 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 2.6 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.62 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.864 HG12 HD13 ' A' ' 44' ' ' LEU . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 1.66 107.1 178.028 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 0.51 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 1.89 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 0.56 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 0.92 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.15 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 3.12 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.864 HD13 HG12 ' A' ' 37' ' ' VAL . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 0.65 105.531 172.043 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.733 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 0.36 101.934 -179.99 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.734 HG23 HD11 ' A' ' 44' ' ' LEU . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 0.9 106.024 171.382 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.35 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 0.9 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.38 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 2.6 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.13 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 0.41 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 2.77 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 0.47 110.34 174.757 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.65 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.628 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 0.47 109.312 177.205 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.512 ' HB2' HD21 ' A' ' 67' ' ' LEU . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 0.89 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 0.38 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 0.39 109.925 174.973 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.48 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 3.99 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 0.5 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 1.92 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 1.45 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 1.59 112.495 173.14 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 6.39 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.33 108.028 170.878 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 3.07 107.865 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.737 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 2.06 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 1.47 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.737 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.37 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 1.98 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.478 HG22 ' HB3' ' A' ' 67' ' ' LEU . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 3.08 110.345 -169.656 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 2.51 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.13 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 2.19 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.061 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.81 114.13 -161.143 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.061 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.7 108.381 -172.774 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 0.37 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 0.3 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.57 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 0.32 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 4.37 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.0 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 0.42 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.42 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.86 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 0.42 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.523 HG13 HG22 ' A' ' 56' ' ' VAL . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 2.13 111.388 173.063 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 1.76 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.81 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 0.53 112.075 -173.429 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 0.54 109.995 -179.23 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.595 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.48 113.372 -177.037 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 0.47 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.28 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 2.86 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 2.26 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.83 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 1.75 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 0.51 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 1.96 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 0.53 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 0.93 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.84 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 2.22 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 0.85 106.043 173.164 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 0.35 103.391 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 0.73 106.586 175.078 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.14 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 0.92 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 p30 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 3.5 103.208 -163.931 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.18 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.595 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 0.65 113.181 -169.888 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.11 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 0.56 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.89 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.671 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 0.52 109.551 178.416 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.01 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 0.89 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 0.38 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 0.49 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.56 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 5.48 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 0.73 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.55 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 1.85 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 1.91 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.478 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 2.07 114.421 175.331 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 3.99 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.42 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.49 110.391 175.112 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 109.376 -0.601 . . . . 6.88 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -59.21 -75.66 0.26 Allowed Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.208 0.909 . . . . 2.09 112.717 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 m -144.14 157.81 44.09 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.166 -2.161 . . . . 1.75 105.166 164.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.58 115.38 23.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 2.59 107.123 170.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.85 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 1.85 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 1.7 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.85 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.47 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 1.7 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG11 ' SD ' ' A' ' 13' ' ' MET . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.21 113.224 -161.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 1.73 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.41 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.479 ' SD ' HG21 ' A' ' 22' ' ' VAL . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 2.17 111.152 -177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.41 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 0.33 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 0.25 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.554 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56 108.087 172.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 0.31 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 5.74 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 2.87 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 0.54 108.247 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.06 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.7 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 0.57 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.426 ' CG1' HG13 ' A' ' 56' ' ' VAL . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 1.92 109.865 175.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 3.71 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.17 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 0.57 112.092 -170.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 0.36 110.641 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.32 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.452 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 0.36 111.979 -175.58 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.04 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 1.77 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 2.43 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.88 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 1.84 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 0.56 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 1.98 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 0.55 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 0.92 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.1 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.05 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 0.76 106.792 170.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.662 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 0.44 105.168 174.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.539 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 0.59 107.635 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.82 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 0.83 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.53 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 2.5 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.05 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 0.45 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 7.77 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' ' CG ' ' A' ' 57' ' ' GLU . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 0.81 111.792 173.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.22 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.727 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 0.34 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.559 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.67 108.451 -167.453 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 1.52 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 0.41 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.697 HD22 HD13 ' A' ' 67' ' ' LEU . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 0.42 110.965 176.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.49 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 2.98 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 0.65 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.53 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 1.86 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.34 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.697 HD13 HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 1.91 110.999 168.321 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 3.45 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -108.28 58.72 0.61 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.4 110.622 170.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 63.64 -176.77 0.16 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.652 0.781 . . . . 3.95 110.208 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -104.05 74.86 1.23 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 107.949 -1.13 . . . . 2.02 107.949 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.46 -158.22 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.038 1.335 . . . . 3.4 111.061 -174.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 . . . . . 0 C--O 1.25 1.082 0 N-CA-C 104.314 -2.476 . . . . 8.81 104.314 -178.108 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 109.808 -0.442 . . . . 5.63 109.808 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 126.42 5.5 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 106.021 -2.832 . . . . 1.21 106.021 -157.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.3 m -143.52 103.8 4.14 Favored 'General case' 0 CA--C 1.506 -0.716 0 CA-C-N 118.856 1.328 . . . . 1.28 108.231 170.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -91.72 123.74 35.34 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 3.34 106.052 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.806 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 2.05 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 1.99 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.806 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.27 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 1.72 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 11' ' ' SER . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 1.92 110.128 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 10' ' ' VAL . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.1 105.533 169.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.08 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.08 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 1.65 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 0.99 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 0.45 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.07 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 0.6 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 4.23 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.33 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 0.43 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.83 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 2.87 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 0.57 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.516 HG13 HG22 ' A' ' 56' ' ' VAL . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 2.27 111.016 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.27 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.21 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 0.87 111.836 -171.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 0.6 109.722 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.57 113.477 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 0.42 111.802 -169.321 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.19 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 1.62 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 2.68 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 1.79 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 1.89 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 3.33 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 1.72 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.47 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.18 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.15 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 0.88 106.644 176.476 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.8 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 0.4 105.288 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.929 HG23 HD11 ' A' ' 44' ' ' LEU . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 0.71 107.236 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.43 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.504 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 0.86 112.086 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.49 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 3.29 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.417 ' O ' HG23 ' A' ' 52' ' ' ILE . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.85 111.05 166.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 0.43 112.181 -174.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 2.38 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 0.5 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.57 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.644 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 0.36 108.772 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HB2' HD11 ' A' ' 67' ' ' LEU . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.06 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 0.35 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' HD23 ' A' ' 67' ' ' LEU . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 0.39 111.012 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.5 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.03 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 0.52 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 1.91 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 1.5 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 2.08 111.889 -178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.33 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.83 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -125.32 58.92 1.27 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 70.04 159.25 0.19 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.003 1.721 . . . . 3.73 113.889 163.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 81.24 8.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.581 -1.19 . . . . 2.01 108.717 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 72.35 -68.24 0.23 Allowed 'General case' 0 C--O 1.231 0.082 0 C-N-CA 124.994 1.317 . . . . 2.87 111.523 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.123 -0.942 . . . . 7.11 108.868 -162.016 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 m . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.843 -0.429 . . . . 6.35 109.843 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 144.44 77.38 0.03 OUTLIER Glycine 0 CA--C 1.529 0.967 0 N-CA-C 109.673 -1.371 . . . . 2.26 109.673 -174.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -109.15 108.32 18.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.596 1.158 . . . . 1.46 108.462 -172.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -95.56 115.79 27.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 2.79 109.163 -169.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.74 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 1.97 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 1.52 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.74 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.38 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 1.97 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 2.52 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.21 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.22 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 2.22 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.39 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.7 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 0.36 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 0.26 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.44 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 0.3 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.26 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 3.87 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 60' ' ' LEU . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 0.45 109.946 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.11 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.87 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 0.45 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.95 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 1.7 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.79 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 0.44 112.013 -171.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 0.4 109.737 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 0.3 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 0.91 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 2.56 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 2.07 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.92 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 1.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 0.6 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 1.98 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 0.72 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 0.95 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.12 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 2.77 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 0.75 107.503 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 0.42 106.233 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.594 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 0.61 107.397 -174.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.14 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 0.85 109.058 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.64 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 3.52 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.44 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 0.37 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 2.62 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 0.4 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.89 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.615 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 0.33 109.616 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.582 ' HA ' HD21 ' A' ' 67' ' ' LEU . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.42 108.691 -169.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 1.96 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 0.31 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 0.47 110.737 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.31 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 4.42 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 0.51 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 1.94 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 1.86 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 2.1 111.401 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 3.49 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.39 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -139.91 51.48 1.71 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 53.71 -169.33 0.06 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.781 -0.645 . . . . 3.99 112.203 170.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.64 63.71 1.04 Allowed 'General case' 0 C--N 1.34 0.175 0 O-C-N 120.627 -1.296 . . . . 1.9 110.138 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.76 68.79 0.68 Allowed 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.569 1.147 . . . . 2.54 108.417 -169.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 C--O 1.25 1.083 0 O-C-N 125.124 1.515 . . . . 6.44 107.606 -162.007 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 107.123 -1.436 . . . . 5.74 107.123 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.21 133.31 2.88 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.126 1.346 . . . . 1.36 109.924 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 m -140.24 146.61 38.85 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 105.515 -2.032 . . . . 1.35 105.515 159.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.32 122.23 46.89 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 2.4 107.452 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.794 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 2.11 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 1.8 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.794 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.31 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 2.22 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 12' ' ' GLY . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 2.45 111.135 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.23 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 10' ' ' VAL . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.05 105.306 175.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.26 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.69 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 0.36 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 0.28 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.47 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 0.39 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 5.16 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 2.62 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 0.55 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.83 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.66 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 0.62 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 2.11 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 1.91 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.07 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 0.6 110.938 -171.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 0.49 109.143 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.55 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.412 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 0.39 112.045 -172.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 0.99 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 1.73 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 2.66 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.63 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 1.76 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 0.55 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 1.81 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 0.61 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 1.2 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.53 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 3.13 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.782 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 0.8 104.894 172.164 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.746 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 0.39 105.313 172.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.782 HG23 HD11 ' A' ' 44' ' ' LEU . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 0.7 107.633 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.66 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.616 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 0.79 110.494 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.41 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 3.56 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.03 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.426 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 0.46 112.722 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 2.88 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 0.46 111.176 172.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.86 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.738 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 0.38 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.557 ' HB2' HD11 ' A' ' 67' ' ' LEU . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.41 110.233 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.01 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 0.42 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.554 ' CD2' HD23 ' A' ' 67' ' ' LEU . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 0.46 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.44 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 2.9 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 0.72 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.51 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 2.05 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 1.64 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' ' 57' ' ' GLU . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 2.02 113.02 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 3.54 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.61 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.49 58.37 1.39 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7 109.622 164.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 61.28 -171.55 0.15 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.868 -1.06 . . . . 3.8 110.75 162.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -128.26 73.43 1.48 Allowed 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.349 -0.844 . . . . 1.93 109.675 -171.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.55 -56.84 0.51 Allowed 'General case' 0 C--O 1.231 0.108 0 C-N-CA 126.029 1.732 . . . . 2.98 110.884 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 116.97 -1.491 . . . . 8.28 107.704 158.864 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 CA--C 1.524 -0.042 0 N-CA-C 107.911 -1.144 . . . . 5.26 107.911 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.68 160.02 37.9 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 109.588 -1.405 . . . . 1.71 109.588 167.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -142.88 123.25 13.88 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 107.097 -1.446 . . . . 1.31 107.097 168.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.29 125.86 41.09 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 3.36 107.624 175.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.674 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 2.42 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 1.49 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.674 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.45 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 2.76 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 2.63 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 1.72 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.41 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 2.11 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.19 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.71 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 0.4 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 0.25 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.49 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 0.34 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 3.77 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 3.14 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.478 HG13 HD11 ' A' ' 60' ' ' LEU . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 0.4 109.345 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.67 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.11 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 0.45 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 2.16 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.04 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.7 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 0.41 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 0.38 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.32 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 0.37 112.061 -169.46 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 0.99 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 2.11 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 2.21 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.87 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.838 HG12 HD13 ' A' ' 44' ' ' LEU . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 1.55 106.58 171.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 0.76 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 1.85 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 0.9 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 0.98 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.47 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 3.45 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD13 HG12 ' A' ' 37' ' ' VAL . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 0.71 104.312 172.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.633 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 0.31 103.189 -176.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 52' ' ' ILE . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 0.71 107.398 176.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.443 ' HB3' ' CE2' ' A' ' 6' ' ' TYR . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 0.72 111.023 -172.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.37 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 2.53 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.35 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.558 HD11 HG11 ' A' ' 46' ' ' VAL . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 0.5 111.382 -175.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.41 109.771 -164.127 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 0.49 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.68 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.658 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 0.39 109.116 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.06 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 0.38 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 HD23 ' A' ' 67' ' ' LEU . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 0.43 110.423 174.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.49 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 2.91 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 0.57 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 1.99 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 1.61 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 2.08 114.132 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 4.26 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.81 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -118.18 55.71 0.88 Allowed 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.41 108.14 162.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 57.24 -174.69 0.07 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.512 1.149 . . . . 3.84 111.445 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -119.09 112.94 20.17 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.191 -2.152 . . . . 2.03 105.191 170.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.94 -175.29 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.021 -1.103 . . . . 4.52 108.021 163.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.305 -0.855 . . . . 11.31 109.314 176.642 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.846 0.355 . . . . 4.78 110.421 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 57.61 -130.41 50.96 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.453 -1.059 . . . . 1.52 110.453 -174.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.469 HG21 ' CE1' ' A' ' 6' ' ' TYR . 10.8 m -143.49 166.26 25.28 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 106.244 -1.761 . . . . 1.73 106.244 163.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -118.91 126.16 51.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 2.68 106.268 163.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.757 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 1.91 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 1.69 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.37 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 4.06 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 1.93 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 2.43 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.08 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 0.35 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 0.25 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 0.24 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.12 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 2.42 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 0.47 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.36 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 0.44 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CG2' HG13 ' A' ' 56' ' ' VAL . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 2.08 111.112 170.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 1.81 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.09 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 0.5 111.45 -173.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 0.39 110.382 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.35 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 0.35 112.286 -173.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.15 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 1.81 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 2.5 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.63 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 2.92 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 0.57 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 1.94 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 0.59 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 0.97 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.02 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 2.79 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 45' ' ' VAL 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 0.86 104.448 -176.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.512 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 0.3 104.61 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.434 HG11 HD11 ' A' ' 52' ' ' ILE . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 0.72 107.246 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.4 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 0.67 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.34 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 2.43 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.16 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.434 HD11 HG11 ' A' ' 46' ' ' VAL . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 0.38 111.729 -177.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.34 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 0.69 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.78 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.725 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 0.43 109.932 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.685 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1 109.544 -172.292 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 0.92 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 0.37 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 0.54 110.365 176.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.46 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 2.86 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 0.47 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 1.86 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 1.39 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.685 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 1.68 112.6 176.521 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.09 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.8 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -118.02 55.55 0.88 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.34 110.217 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.8 143.36 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.565 1.546 . . . . 5.43 112.556 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.22 72.66 4.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.764 -1.107 . . . . 2.03 108.931 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 83.27 -158.93 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 2.92 111.372 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.208 -2.515 . . . . 7.91 104.208 176.943 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 105.017 -2.216 . . . . 6.68 105.017 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.4 152.5 21.96 Favored Glycine 0 N--CA 1.444 -0.81 0 N-CA-C 103.974 -3.65 . . . . 1.78 103.974 159.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.3 m -135.17 110.65 9.12 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 119.237 1.519 . . . . 1.13 108.003 169.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.48 120.76 33.28 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 2.87 105.172 174.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.836 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 1.99 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 1.54 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.836 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.41 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 1.61 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.436 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.11 112.542 -163.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.05 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.512 ' SD ' HG21 ' A' ' 22' ' ' VAL . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.14 112.299 -170.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 0.39 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 0.37 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 0.37 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 3.39 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 2.43 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' CYS . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 0.42 108.684 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.9 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 0.44 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.595 HG13 HG22 ' A' ' 56' ' ' VAL . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 2.24 111.434 176.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.05 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.86 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 0.59 111.548 -172.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 0.44 111.175 -177.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.42 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 0.36 111.319 -175.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.31 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 2.07 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 2.11 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.49 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.529 HG12 HD13 ' A' ' 44' ' ' LEU . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 1.56 109.302 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 0.59 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 1.84 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 0.63 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.03 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.64 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 2.26 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.884 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 0.55 105.123 172.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.706 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 0.43 106.499 173.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.884 HG23 HD11 ' A' ' 44' ' ' LEU . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 0.73 108.457 178.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.31 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.56 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 2.64 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.87 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.502 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 0.41 111.298 175.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 3.57 111.775 -176.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 0.49 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 0.37 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.742 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.43 110.482 -175.54 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 0.92 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 0.31 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 0.45 110.212 174.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.49 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.01 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 0.48 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 22' ' ' VAL . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 1.89 110.942 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 2.91 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 1.86 113.609 174.914 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.29 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.57 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -117.94 57.36 0.83 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.36 110.2 171.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 69.04 148.29 0.06 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 125.85 1.66 . . . . 3.74 112.385 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.38 77.37 7.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.956 -1.02 . . . . 2.38 109.841 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 70.44 -176.88 0.2 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.758 0.823 . . . . 2.8 111.517 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.021 1.328 . . . . 7.95 109.787 178.886 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.539 0.537 0 CA-C-O 119.144 -0.455 . . . . 6.52 110.793 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.23 136.95 8.79 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.427 -1.069 . . . . 2.11 110.427 -174.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.66 126.75 40.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.714 -1.588 . . . . 1.45 106.714 178.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -96.51 137.6 35.35 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 2.39 107.457 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.704 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 1.94 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 1.71 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.704 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.44 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 1.79 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.12 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.0 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.36 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 2.22 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.61 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 0.35 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 0.33 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.535 ' O ' HG23 ' A' ' 22' ' ' VAL . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.49 109.046 172.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 0.26 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 3.85 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 2.37 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 18' ' ' CYS . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 0.55 109.838 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.85 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 2.82 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 0.48 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.771 HG22 HG11 ' A' ' 32' ' ' VAL . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 2.57 110.679 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 1.94 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 0.92 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 1.16 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 0.59 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.453 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.48 113.269 -170.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.771 HG11 HG22 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 0.35 110.841 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 0.95 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 1.99 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 2.13 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.62 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.749 HG12 HD13 ' A' ' 44' ' ' LEU . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 1.64 106.412 173.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 0.55 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 1.94 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 0.52 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 0.97 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.61 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 2.87 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 0.65 105.429 175.024 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.781 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 0.37 103.065 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.595 HG23 HD11 ' A' ' 44' ' ' LEU . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 0.85 107.292 171.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.12 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 0.92 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.5 p30 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 3.26 104.312 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 0.62 113.932 -177.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 2.78 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.443 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 0.44 111.011 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.24 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 26' ' ' VAL . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 0.67 108.582 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 1.09 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 0.33 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 67' ' ' LEU . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 0.49 110.633 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.49 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 2.69 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 0.45 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.43 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 2.0 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 2.62 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 60' ' ' LEU 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 1.72 113.563 179.934 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 3.27 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.72 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -120.54 61.3 0.88 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 64.3 -177.87 0.17 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.981 0.912 . . . . 5.06 111.936 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.76 62.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 107.613 -1.255 . . . . 1.87 107.613 -175.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.87 -51.4 0.57 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 126.038 1.735 . . . . 3.34 111.153 -166.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 65.6 mt-10 . . . . . 0 C--O 1.258 1.518 0 C-N-CA 127.603 2.361 . . . . 6.45 105.918 166.936 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 107.375 -1.343 . . . . 4.72 107.375 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.62 -178.89 44.08 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.657 -1.377 . . . . 1.12 109.657 169.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.89 119.04 13.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.267 -1.383 . . . . 1.41 107.267 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.67 128.44 42.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 3.3 107.607 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.594 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 2.19 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 1.48 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.742 ' CE3' HG11 ' A' ' 56' ' ' VAL . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.47 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 2.8 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 2.66 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.07 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.43 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.01 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.59 113.649 -174.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.74 108.96 -168.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 0.44 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 0.26 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 0.3 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 3.62 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 2.58 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.735 HG13 HD11 ' A' ' 60' ' ' LEU . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 0.4 110.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.86 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 2.37 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 0.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 56' ' ' VAL . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 1.86 111.201 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 3.97 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 0.95 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 55' ' ' GLN . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 0.64 112.103 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 0.52 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.38 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.438 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 0.46 110.909 -173.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.17 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 2.27 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 2.14 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.43 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.662 HG12 HD13 ' A' ' 44' ' ' LEU . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 1.68 107.706 175.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 0.53 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 2.18 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 0.54 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.15 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.57 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 2.7 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.762 HD12 ' N ' ' A' ' 45' ' ' VAL 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 0.59 105.07 177.688 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.762 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 0.29 104.551 -179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 0.99 105.204 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.03 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.62 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 2.42 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.3 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.605 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 0.48 111.699 -176.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 2.8 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 0.43 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB3' HD13 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.08 110.592 174.366 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.742 HG11 ' CE3' ' A' ' 8' ' ' TRP . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 0.44 109.394 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 67' ' ' LEU . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.94 110.509 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 0.84 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 0.47 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.735 HD11 HG13 ' A' ' 22' ' ' VAL . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 0.49 111.207 175.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.61 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 3.61 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 0.58 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.47 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 2.1 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 2.12 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.591 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 2.02 111.457 -178.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 3.44 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.413 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.12 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -134.14 62.14 1.66 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.02 109.032 164.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -58.5 155.52 12.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.021 -1.072 . . . . 7.57 109.197 160.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -160.5 -59.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.073 -1.421 . . . . 5.07 108.345 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 62.74 -178.86 0.14 Allowed 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.013 0.82 . . . . 2.96 110.479 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.189 1.796 . . . . 9.25 112.596 -172.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.382 0.512 . . . . 4.3 112.382 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -129.5 -146.8 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.729 -1.349 . . . . 1.16 109.729 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.8 158.7 26.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 106.472 -1.677 . . . . 1.26 106.472 170.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.23 129.49 50.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 2.37 106.901 171.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 1.9 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 1.89 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.37 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 2.62 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 1.82 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.02 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.36 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 2.12 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.71 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 0.41 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 0.28 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45 108.695 172.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 0.34 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 3.44 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 3.21 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 18' ' ' CYS . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 0.43 108.906 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.12 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.9 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 0.41 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.457 ' CG1' HG13 ' A' ' 56' ' ' VAL . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 1.87 111.242 170.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 1.83 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.27 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 0.46 112.606 -169.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 0.49 111.011 -176.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.37 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 0.45 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.08 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 2.32 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 1.98 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.26 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 1.68 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 0.52 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 2.01 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 0.7 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.3 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.47 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 2.63 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 0.81 105.734 175.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 0.59 105.324 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.492 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 0.81 106.05 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.92 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 0.72 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.74 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 2.48 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.43 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.492 HD11 HG11 ' A' ' 46' ' ' VAL . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 0.42 110.773 -178.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 2.65 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 0.61 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.41 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.775 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 0.35 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.439 ' HB2' HD21 ' A' ' 67' ' ' LEU . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.81 109.915 -176.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.13 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 0.4 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.622 HD22 HD13 ' A' ' 67' ' ' LEU . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 0.52 110.643 176.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.53 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 2.86 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 0.6 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.6 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 1.97 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 1.43 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.622 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 1.59 112.876 175.502 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 3.33 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.19 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -129.49 60.96 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.86 109.34 161.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -54.67 170.62 0.16 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.296 1.046 . . . . 7.54 111.503 158.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 49.6 40.19 18.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 113.825 -1.534 . . . . 4.2 111.473 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 133.3 54.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 123.245 0.618 . . . . 5.4 109.707 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 . . . . . 0 C--O 1.249 1.066 0 N-CA-C 106.935 -1.506 . . . . 7.63 106.935 165.386 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.3 m . . . . . 0 C--O 1.227 -0.081 0 N-CA-C 110.149 -0.315 . . . . 5.68 110.149 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.11 173.84 38.35 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.285 -1.126 . . . . 1.33 110.285 170.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.8 m -143.02 113.45 7.35 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 121.47 -1.018 . . . . 1.11 108.583 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 115.95 28.44 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 2.68 106.854 177.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.756 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 2.09 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 1.59 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.44 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 2.41 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.06 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 1.75 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.43 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 2.54 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.6 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 0.34 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 0.27 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 0.25 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 3.54 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 2.57 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 HD11 ' A' ' 60' ' ' LEU . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 0.55 109.862 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.26 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.76 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 0.55 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.465 ' CG1' HG13 ' A' ' 56' ' ' VAL . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 1.8 110.333 171.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 1.73 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 0.81 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 0.4 111.966 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 0.39 110.569 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.35 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 0.35 111.467 -172.489 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.09 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 1.99 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 2.07 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.61 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 44' ' ' LEU . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 1.69 108.526 174.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 0.51 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 1.81 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 0.57 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 0.98 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.12 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 2.31 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 0.72 107.01 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.653 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 0.41 106.842 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.566 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 0.82 105.769 -173.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 0.73 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 2.45 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.35 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 0.49 112.985 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.07 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 0.57 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.38 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.678 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 0.37 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HB2' HD21 ' A' ' 67' ' ' LEU . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.24 109.654 -171.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 0.87 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 0.48 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.658 HD22 HD13 ' A' ' 67' ' ' LEU . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 0.48 109.404 175.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 4.16 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 2.76 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 0.55 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 1.87 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.2 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.658 HD13 HD22 ' A' ' 60' ' ' LEU 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 1.77 111.239 168.417 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 5.59 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -132.42 56.97 1.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.45 107.859 172.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.96 155.08 37.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.061 -1.024 . . . . 8.39 108.625 168.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.24 94.34 0.06 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.639 1.575 . . . . 4.25 111.883 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.1 -46.69 5.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 114.92 1.452 . . . . 4.55 114.92 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.258 1.5 0 N-CA-C 103.156 -2.905 . . . . 7.74 103.156 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 112.414 0.524 . . . . 4.04 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 160.06 -164.47 34.32 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 107.047 -2.421 . . . . 1.36 107.047 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -122.74 129.83 52.21 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 106.097 -1.816 . . . . 1.5 106.097 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -97.47 127.41 43.4 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 2.85 106.887 169.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.756 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 2.38 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 1.58 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.38 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 1.67 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HE3' ' A' ' 13' ' ' MET . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.09 112.917 -166.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.1 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.56 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.554 ' HE3' HG21 ' A' ' 10' ' ' VAL . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 2.6 112.936 -175.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.41 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 0.55 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 0.38 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.464 ' O ' HG23 ' A' ' 22' ' ' VAL . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.72 108.655 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 0.32 111.643 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 3.88 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.09 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HE2' ' A' ' 13' ' ' MET . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 0.4 108.566 175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.36 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.08 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 0.54 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 1.95 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 2.25 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.85 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 0.44 112.571 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 0.38 111.308 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.446 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 0.43 111.371 -173.121 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 0.93 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 1.7 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 2.34 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.87 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.579 HG22 HD13 ' A' ' 44' ' ' LEU . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 2.33 108.177 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 0.69 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 2.03 110.502 172.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 0.54 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 1.09 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.49 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 2.35 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 0.78 106.229 174.796 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.72 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 0.3 104.867 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.67 HG23 HD11 ' A' ' 44' ' ' LEU . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 0.88 106.403 -179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.45 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 0.7 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.64 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 2.5 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.402 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 0.48 112.675 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 2.92 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 0.57 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.15 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.668 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 0.32 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.01 110.073 -174.681 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 0.92 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 0.32 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.456 HD11 HG13 ' A' ' 22' ' ' VAL . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 0.56 110.635 176.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.46 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.28 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 0.46 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 1.86 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.54 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 57' ' ' GLU 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 1.72 113.246 172.826 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 3.96 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.23 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -111.2 60.54 0.61 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 59.48 -171.93 0.12 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.0 0.37 . . . . 4.84 112.0 169.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -124.23 56.13 1.27 Allowed 'General case' 0 C--N 1.34 0.174 0 O-C-N 121.171 -0.956 . . . . 1.83 109.626 -173.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 63.46 69.29 0.57 Allowed 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.419 1.088 . . . . 2.67 109.141 -169.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 . . . . . 0 C--O 1.258 1.501 0 CA-C-O 116.843 -1.551 . . . . 6.48 108.22 -158.67 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 106.452 -1.685 . . . . 6.23 106.452 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.9 164.1 11.32 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 107.264 -2.334 . . . . 2.25 107.264 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.6 m -132.57 122.22 24.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.465 -1.309 . . . . 1.4 107.465 174.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -98.09 109.55 22.29 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 2.62 106.934 176.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.868 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 2.2 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 1.42 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.868 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.29 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 1.65 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.04 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 1.8 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.34 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.07 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.58 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 0.37 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 0.38 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 0.36 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 3.54 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 2.45 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 60' ' ' LEU . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 0.7 109.649 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.06 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.03 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 0.54 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 2.01 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.03 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 0.89 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 0.55 112.045 -170.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 0.4 110.721 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.39 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 0.35 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.04 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 1.99 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 1.94 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.15 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.735 HG12 HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 1.81 108.586 -179.332 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 0.58 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 2.02 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 0.58 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 0.96 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.11 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.12 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 0.84 106.008 173.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.785 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 0.36 106.626 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.772 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 0.74 107.356 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.12 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 0.63 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.22 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 2.42 102.759 172.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 0.48 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 2.85 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 0.58 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.602 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 0.34 109.841 175.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.09 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.08 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 0.46 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 22' ' ' VAL . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 0.47 110.183 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.57 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 2.96 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 0.5 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.49 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 1.9 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 1.62 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 2.11 112.567 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.29 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.11 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -111.42 60.9 0.61 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.39 108.542 167.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 56.5 mm-40 60.66 -178.79 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.002 0.921 . . . . 3.85 112.263 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.27 83.4 1.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.535 1.134 . . . . 2.02 108.463 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 73.79 52.2 0.11 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 2.54 113.498 171.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 107.139 -1.43 . . . . 7.02 107.139 156.038 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.956 -0.387 . . . . 3.93 109.956 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.85 -104.54 1.61 Allowed Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.417 -1.873 . . . . 2.2 108.417 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 88.2 m -142.07 132.73 25.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.058 -1.26 . . . . 1.57 108.734 165.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.431 HH21 ' C ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -96.33 115.52 27.56 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 3.6 106.314 174.066 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 2.16 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 1.43 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.61 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 1.56 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 2.97 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 1.73 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 5.18 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.67 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 0.38 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 0.47 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 0.3 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.3 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 2.62 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 0.79 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.07 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.76 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 0.61 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 1.79 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 1.83 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.05 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 0.64 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 0.52 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.49 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 0.46 110.98 -173.554 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 0.96 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 2.32 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 1.84 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.611 HG22 HD13 ' A' ' 44' ' ' LEU . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 2.39 108.118 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 0.53 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 1.84 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 0.67 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 2.64 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.02 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.15 110.949 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.611 HD13 HG22 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 0.9 104.109 -175.902 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.582 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 0.29 107.087 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 0.62 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 0.7 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.61 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 2.54 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.51 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 0.83 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.24 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 0.55 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.56 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 0.85 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HA ' HD21 ' A' ' 67' ' ' LEU . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.89 107.799 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.14 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 0.91 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 0.76 110.017 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.78 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 3.64 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.31 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.16 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 2.52 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 1.86 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.623 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 1.82 110.524 165.241 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 4.4 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.25 62.08 7.27 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.12 108.647 168.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 61.96 173.44 0.13 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.998 1.719 . . . . 3.88 114.392 168.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.72 52.02 2.22 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.403 -1.271 . . . . 1.97 109.731 173.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 155.09 165.67 0.01 OUTLIER 'General case' 0 C--N 1.339 0.112 0 C-N-CA 127.667 2.387 . . . . 4.2 108.934 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.431 ' C ' HH21 ' A' ' 5' ' ' ARG . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.424 0 C-N-CA 130.707 3.603 . . . . 10.89 101.438 -153.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 110.088 -0.338 . . . . 4.53 110.088 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 65.55 -168.88 30.44 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 108.958 -1.657 . . . . 1.39 108.958 -163.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.78 169.52 16.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.149 -2.537 . . . . 1.95 104.149 148.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -129.86 135.14 48.04 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 2.37 105.544 163.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.795 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 2.01 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 1.59 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.795 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.39 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 1.86 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 1.81 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 2.77 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.31 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HG2' HG21 ' A' ' 22' ' ' VAL . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.23 113.072 -174.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.37 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 0.34 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 0.31 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.555 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51 109.128 172.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 0.28 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.07 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 4.13 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 0.55 108.981 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.33 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.89 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 0.44 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 56' ' ' VAL . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 2.16 111.071 171.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.09 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.82 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 0.55 111.561 -174.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 0.33 110.877 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.31 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 0.38 111.459 -174.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.19 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 1.81 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 2.36 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.47 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 2.85 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 0.52 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 1.84 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 0.55 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.3 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.14 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.57 HD12 ' N ' ' A' ' 45' ' ' VAL 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 0.92 105.048 -178.669 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.57 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 0.32 104.73 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 52' ' ' ILE . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 0.76 106.798 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.08 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 0.94 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.61 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 2.51 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.09 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.494 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 0.4 110.904 -174.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.37 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 0.63 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.85 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 0.4 110.141 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.535 ' HA ' HD21 ' A' ' 67' ' ' LEU . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.92 108.816 -173.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.25 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 0.44 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.431 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 0.59 111.756 178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 1.54 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 3.74 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 0.56 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.48 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.464 ' CE2' HG22 ' A' ' 22' ' ' VAL . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 1.84 109.265 174.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 1.66 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 2.01 111.218 -177.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 4.27 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.16 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -121.76 58.77 1.0 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.85 108.582 170.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 58.31 -173.54 0.09 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.265 0.555 . . . . 3.84 111.067 177.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.13 69.23 1.48 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.549 0.739 . . . . 1.9 109.693 -173.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.65 116.39 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.297 1.439 . . . . 2.78 111.804 -172.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 C--O 1.254 1.302 0 CA-C-O 116.758 -1.591 . . . . 6.7 108.699 -169.186 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 109.259 -0.645 . . . . 5.01 109.259 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -175.93 -177.71 45.17 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 107.922 -2.071 . . . . 1.39 107.922 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 49.9 m -113.29 122.56 47.79 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 125.072 1.349 . . . . 1.42 108.678 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.579 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -97.28 133.85 41.35 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 124.052 0.845 . . . . 2.76 108.963 162.584 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.774 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 2.06 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 1.61 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.774 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.35 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 1.96 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.03 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 1.79 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.42 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.14 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.42 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 0.35 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 0.26 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 0.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 3.44 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 2.78 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.446 HG13 HD11 ' A' ' 60' ' ' LEU . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 0.68 110.467 -172.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.83 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.59 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 0.52 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 HG13 ' A' ' 56' ' ' VAL . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 1.82 110.606 170.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 3.26 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 0.89 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 0.44 112.273 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 0.35 110.631 -178.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.32 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 0.33 112.258 -169.297 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.06 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 2.4 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 1.97 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.35 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.653 HG12 HD13 ' A' ' 44' ' ' LEU . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 1.77 108.697 177.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 0.66 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 1.88 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 0.86 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 1.33 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.27 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 2.34 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 0.66 105.3 -179.613 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.671 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 0.4 105.942 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 0.68 106.477 -178.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.26 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.62 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 2.6 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.32 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.507 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 0.39 113.635 176.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 2.88 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 0.56 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.19 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.697 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 0.34 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.713 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 0.95 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 0.39 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 HD13 ' A' ' 67' ' ' LEU . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 0.61 110.218 173.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.48 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 3.49 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 0.54 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.45 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 1.85 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 1.37 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.713 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 1.86 113.019 171.131 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.22 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.07 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -120.99 56.43 1.01 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.51 110.821 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 70.01 147.92 0.07 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.293 1.837 . . . . 3.79 112.398 166.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -77.98 71.45 4.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.289 -0.869 . . . . 2.16 109.378 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 75.19 89.24 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.721 1.208 . . . . 2.55 111.538 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 . . . . . 0 C--O 1.257 1.488 0 N-CA-C 106.429 -1.693 . . . . 7.47 106.429 166.258 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.753 0.311 . . . . 4.99 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.4 -167.26 17.45 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.25 -1.94 . . . . 1.86 108.25 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.3 m -113.17 104.53 12.44 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 105.421 -2.066 . . . . 1.18 105.421 -163.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.24 111.95 23.96 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 2.95 106.502 -172.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.83 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 2.05 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.15 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.83 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.37 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 1.66 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.01 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 2.96 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.74 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 2.47 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.56 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.74 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 0.55 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 0.35 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.609 ' O ' HG23 ' A' ' 22' ' ' VAL . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 0.38 111.042 175.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 3.42 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 3.59 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 18' ' ' CYS . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 0.51 108.423 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.85 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 2.75 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 0.52 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.46 ' CG1' HG13 ' A' ' 56' ' ' VAL . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 1.87 110.039 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 3.71 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 0.83 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 0.48 112.226 -171.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 0.53 109.501 178.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 0.48 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 0.98 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 2.65 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 2.43 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.3 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.694 HG22 HD13 ' A' ' 44' ' ' LEU . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 2.23 107.742 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 0.68 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 1.95 110.527 172.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 0.65 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 1.28 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.12 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.06 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.694 HD13 HG22 ' A' ' 37' ' ' VAL 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 0.77 104.231 178.48 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.67 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 0.32 105.226 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG11 HD11 ' A' ' 52' ' ' ILE . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 0.6 106.203 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.37 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.19 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.84 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 3.51 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.28 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.561 HD11 HG11 ' A' ' 46' ' ' VAL . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 0.47 114.412 178.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.442 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 2.7 112.617 173.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 0.81 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.01 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 0.33 109.728 -174.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.11 109.892 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 0.86 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 0.32 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.45 ' CD2' HD23 ' A' ' 67' ' ' LEU . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 0.5 110.423 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.48 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.11 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 0.49 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 1.86 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 1.55 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.525 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 2.07 112.941 179.164 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 4.32 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.87 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -117.67 61.22 0.76 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.93 109.574 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 66.28 174.14 0.24 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 122.802 1.287 . . . . 5.47 111.742 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -126.51 103.11 7.42 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 105.474 -2.047 . . . . 1.93 105.474 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.9 124.23 24.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.149 -1.056 . . . . 4.86 108.149 171.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 128.569 2.748 . . . . 11.24 104.388 -175.67 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 109.555 -0.535 . . . . 4.03 109.555 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.55 -128.36 0.4 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.682 -0.967 . . . . 1.72 110.682 -170.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 m -144.47 123.01 12.44 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.76 -1.57 . . . . 1.15 106.76 168.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.79 106.76 18.68 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 3.44 103.846 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 2.15 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 1.58 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.36 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 1.64 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 2.49 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 1.85 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.57 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 2.58 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 0.35 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 0.31 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 0.47 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 3.7 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 3.66 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 18' ' ' CYS . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 0.51 110.001 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.82 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.07 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 0.41 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.541 ' CG2' HG13 ' A' ' 56' ' ' VAL . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 2.15 111.167 176.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 1.84 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 0.84 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 0.42 112.586 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 0.39 110.782 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.34 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 0.31 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.04 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 1.86 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 2.3 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.89 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.599 HG22 HD13 ' A' ' 44' ' ' LEU . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.55 107.839 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 0.6 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 1.92 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 0.71 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 1.43 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.39 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 2.28 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.599 HD13 HG22 ' A' ' 37' ' ' VAL 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 0.83 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.44 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 0.35 105.571 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 52' ' ' ILE . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 0.7 108.047 177.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.26 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 0.67 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.51 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 2.57 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.13 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.513 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 0.42 111.758 173.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.0 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 0.41 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.45 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.666 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 0.35 109.613 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.774 ' HB2' HD21 ' A' ' 67' ' ' LEU . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.07 109.689 -168.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 0.89 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 0.48 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 0.69 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.49 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 3.43 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 0.48 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.45 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.47 ' CE2' HG22 ' A' ' 22' ' ' VAL . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 2.24 110.152 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 1.67 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.774 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 1.83 114.74 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 4.09 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.97 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.73 51.45 2.13 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.42 108.634 169.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 63.8 147.86 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.086 2.555 . . . . 3.66 115.227 167.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.43 74.96 9.28 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 114.303 -1.317 . . . . 2.02 108.954 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.83 -152.06 0.37 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.757 1.223 . . . . 2.64 111.156 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 128.461 2.705 . . . . 6.31 104.033 173.827 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.508 0.194 . . . . 4.6 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.52 -149.5 20.38 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.546 -2.621 . . . . 1.17 106.546 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -141.39 127.4 19.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.477 1.139 . . . . 0.96 108.264 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -96.74 102.94 14.81 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 2.4 107.479 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 1.9 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 1.86 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.717 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.43 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 2.99 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 11' ' ' SER . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.08 109.851 -178.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.437 ' H ' HG22 ' A' ' 10' ' ' VAL . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.15 106.113 169.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.4 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.16 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.42 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 0.26 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.47 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 0.31 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 4.74 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 2.92 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 0.38 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.15 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.67 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 0.43 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.431 HG13 HG22 ' A' ' 56' ' ' VAL . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 2.15 110.728 175.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 2.75 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.77 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 0.45 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 0.4 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.535 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.43 113.455 -171.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 0.54 110.927 -177.449 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 0.93 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 1.7 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 2.44 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.22 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 1.59 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 0.68 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 2.06 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 0.68 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.14 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.78 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 2.96 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 0.74 104.818 173.673 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.769 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 0.38 106.237 176.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.736 HG23 HD11 ' A' ' 44' ' ' LEU . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 0.78 107.25 -171.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.31 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 0.7 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.14 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 p30 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 3.63 103.797 -170.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.53 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.535 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 0.53 113.378 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.415 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 2.55 111.061 -170.772 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 0.58 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.717 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 0.4 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HG3' HD13 ' A' ' 67' ' ' LEU . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.44 107.886 -174.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 0.84 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 0.42 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 0.55 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.57 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 5.5 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 0.88 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 1.97 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 1.84 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 2.13 113.345 177.357 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.26 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.59 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -103.81 70.61 1.02 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.85 109.109 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.1 mp0 61.58 -179.07 0.12 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.513 1.149 . . . . 4.94 110.789 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -125.43 76.78 1.59 Allowed 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.648 -0.871 . . . . 2.3 108.648 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.04 87.52 0.11 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.294 1.038 . . . . 2.86 112.358 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 116.876 -1.535 . . . . 7.32 109.802 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 106.223 -1.769 . . . . 5.31 106.223 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.38 141.91 11.33 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 108.734 -1.746 . . . . 1.34 108.734 -169.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.37 127.03 27.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.787 -1.931 . . . . 1.65 105.787 173.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -97.77 147.44 24.38 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.474 1.109 . . . . 2.56 108.044 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.656 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 2.1 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 1.47 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.678 ' CE3' HG11 ' A' ' 56' ' ' VAL . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.38 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 2.13 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 11' ' ' SER . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 2.26 109.944 -172.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' HG22 ' A' ' 10' ' ' VAL . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 2.71 108.925 169.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.12 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 2.38 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.6 110.457 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 0.34 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 0.31 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.47 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 0.25 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 5.26 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 2.65 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.439 HG13 HD11 ' A' ' 60' ' ' LEU . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 0.39 108.333 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.82 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 0.61 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG11 HG13 ' A' ' 56' ' ' VAL . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 1.97 110.671 170.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 1.67 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 0.92 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 0.53 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 0.53 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.37 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 0.48 110.932 -171.289 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 0.97 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 2.14 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 2.27 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 1.72 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 0.8 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 1.87 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 0.58 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 1.01 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.35 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 2.34 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 0.91 106.003 177.691 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 0.54 103.516 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.564 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 0.93 105.018 -176.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.38 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 0.89 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.39 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 3.66 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.37 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.452 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 0.59 111.827 -171.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.22 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 0.58 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.93 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' CE3' ' A' ' 8' ' ' TRP . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 0.44 108.849 176.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.827 ' HB2' HD21 ' A' ' 67' ' ' LEU . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.69 111.265 -173.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.31 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 0.48 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD22 HD13 ' A' ' 67' ' ' LEU . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 0.63 110.872 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.47 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 2.78 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 0.53 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.59 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 1.96 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 2.21 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 1.83 113.674 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.27 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.58 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.76 61.45 1.67 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.53 110.511 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.6 152.91 44.37 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 120.462 -1.399 . . . . 7.45 110.835 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -165.83 -54.06 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.351 1.061 . . . . 5.68 108.822 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.81 -70.68 0.14 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.038 1.335 . . . . 4.65 111.462 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 C--O 1.247 0.923 0 N-CA-C 108.046 -1.094 . . . . 8.58 108.046 158.229 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 120.595 0.236 . . . . 4.72 110.429 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.11 -176.58 41.43 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 109.873 -1.291 . . . . 1.35 109.873 166.106 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -125.93 118.02 24.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.542 1.537 . . . . 1.36 107.853 -177.092 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -96.88 133.05 42.01 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 2.64 107.765 173.178 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.906 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 2.51 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 1.95 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.906 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.28 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 2.16 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.484 HG21 ' HE3' ' A' ' 13' ' ' MET . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 1.83 113.754 -171.197 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.17 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.43 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.491 ' CE ' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 3.01 112.896 -163.314 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.18 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.38 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 0.34 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.49 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 0.34 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 4.63 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 4.07 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG11 ' CE ' ' A' ' 13' ' ' MET . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 0.38 109.045 178.863 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.9 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.72 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.47 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 56' ' ' VAL . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 1.87 111.536 172.426 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.01 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 0.88 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 0.44 112.115 -169.947 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 0.36 110.645 -178.15 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.35 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 0.35 112.117 -169.486 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.01 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 2.06 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 2.14 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 2.39 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 0.5 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 1.86 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 0.58 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.19 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.36 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 3.22 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 0.64 104.916 174.495 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 0.44 103.666 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.593 HG23 HD11 ' A' ' 44' ' ' LEU . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 0.86 106.537 -178.285 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.13 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.05 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.57 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 2.48 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.16 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.414 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 0.48 113.473 176.65 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 2.85 112.64 179.112 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 0.63 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.07 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.673 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 0.33 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.15 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 0.99 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 0.3 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.679 HD22 HD23 ' A' ' 67' ' ' LEU . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 0.45 110.116 175.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.55 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 3.79 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 0.77 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 1.87 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 1.6 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.679 HD23 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 2.13 113.112 174.28 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 4.56 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.72 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -125.41 59.35 1.26 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.63 110.009 166.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 64.01 168.58 0.16 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.947 1.699 . . . . 4.81 113.449 173.216 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.36 71.67 1.38 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.127 -1.397 . . . . 1.9 108.838 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 64.99 102.21 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.031 0.932 . . . . 2.56 113.353 -176.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 . . . . . 0 C--O 1.257 1.449 0 CA-C-O 116.464 -1.731 . . . . 7.72 106.452 138.312 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 105.825 -1.917 . . . . 5.44 105.825 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -151.89 -87.24 0.06 OUTLIER Glycine 0 CA--C 1.522 0.519 0 N-CA-C 109.067 -1.613 . . . . 1.55 109.067 -176.874 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.0 m -144.35 150.82 38.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 105.974 -1.862 . . . . 1.25 105.974 161.046 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -104.28 121.91 44.31 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 3.54 107.076 166.711 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.882 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 2.24 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 1.65 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.882 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.58 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 1.96 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 3.06 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.4 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.01 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 7.49 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.81 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB2' ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 0.85 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 0.83 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.36 107.023 173.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 0.52 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 6.31 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 3.33 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 0.53 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.84 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 2.79 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 0.52 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 56' ' ' VAL . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 2.15 111.139 175.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 1.73 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 0.88 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 0.64 112.121 -170.086 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 0.58 109.8 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.539 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.56 114.33 -177.246 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 0.35 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.18 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 2.62 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 2.24 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.84 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 2.21 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 0.5 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 1.85 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 0.66 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.18 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.67 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 2.61 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.7 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 0.72 105.629 177.573 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.7 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 0.43 106.58 171.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 0.71 108.401 171.333 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 0.75 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.3 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 3.09 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 52' ' ' ILE . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.47 111.457 171.674 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.539 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 0.52 112.675 -174.154 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.08 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.49 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.11 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.688 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 0.4 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HA ' HD21 ' A' ' 67' ' ' LEU 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.86 109.045 -166.584 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 1.86 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 0.33 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.811 HD22 HD13 ' A' ' 67' ' ' LEU . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 0.46 110.912 176.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.5 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 3.59 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 0.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 2.0 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.54 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.811 HD13 HD22 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 1.77 113.212 176.783 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 6.37 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.74 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -120.42 57.76 0.94 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.93 109.547 165.506 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 64.73 -178.58 0.17 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 126.81 2.044 . . . . 3.96 112.352 162.133 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.8 68.7 1.16 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.152 -1.425 . . . . 2.15 107.152 -167.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.89 -63.05 0.44 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.725 0.81 . . . . 3.0 110.394 -167.173 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--O 1.25 1.08 0 N-CA-C 106.611 -1.626 . . . . 7.09 106.611 164.025 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 110.659 -0.126 . . . . 6.42 110.659 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.75 -95.72 0.05 OUTLIER Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.968 -0.853 . . . . 1.38 110.968 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.1 m -144.13 126.51 15.8 Favored 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 121.168 -1.195 . . . . 1.07 109.638 165.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.6 127.11 40.32 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 3.13 108.614 169.203 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.82 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 1.87 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 1.53 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.82 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.4 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 1.65 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 1.94 112.02 -161.213 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 1.87 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.31 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.425 ' SD ' HG11 ' A' ' 10' ' ' VAL . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 2.47 112.643 -166.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.42 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.62 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 0.41 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 0.31 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 0.33 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.13 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.08 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 0.43 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 0.45 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.431 ' CG1' HG13 ' A' ' 56' ' ' VAL . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 1.73 110.945 174.919 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 1.79 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.7 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 0.49 112.359 -170.249 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 0.5 110.789 -176.345 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.44 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 0.48 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.07 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 1.85 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 2.58 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.66 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 1.81 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 0.63 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 1.83 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.34 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 2.32 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 3.07 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD12 ' H ' ' A' ' 45' ' ' VAL . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 0.76 103.609 168.821 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.52 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 0.33 103.775 176.512 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.499 HG23 HD11 ' A' ' 44' ' ' LEU . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 0.6 106.971 -177.752 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.12 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 0.81 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.36 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 2.63 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.11 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.465 HD13 HG23 ' A' ' 56' ' ' VAL . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 0.42 108.672 173.133 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 2.88 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.63 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.17 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.752 HG11 ' HZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 0.38 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.65 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.06 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 0.39 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.685 HD22 HD13 ' A' ' 67' ' ' LEU . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 0.46 110.322 173.501 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.47 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 2.76 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 0.49 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.61 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 1.93 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.12 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.685 HD13 HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 1.77 113.763 172.764 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 3.45 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -123.49 57.24 1.17 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.35 108.948 167.089 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 60.46 -178.8 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 122.881 1.324 . . . . 4.33 111.532 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -122.65 120.27 33.21 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 102.654 -3.091 . . . . 1.87 102.654 174.445 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -46.09 76.34 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.455 -0.498 . . . . 3.49 110.27 -178.556 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.669 1.187 . . . . 10.61 110.302 -175.664 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.23 0.075 0 N-CA-C 110.164 -0.31 . . . . 5.76 110.164 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.67 -167.3 22.33 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.718 -0.953 . . . . 2.09 110.718 173.914 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.5 m -96.16 115.06 26.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 106.277 -1.749 . . . . 1.43 106.277 173.27 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.28 131.17 40.16 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 2.83 106.429 169.218 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.772 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 2.08 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 1.68 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.772 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.47 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 2.09 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.559 HG22 ' H ' ' A' ' 11' ' ' SER . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 1.7 109.559 -168.021 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.559 ' H ' HG22 ' A' ' 10' ' ' VAL . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 2.8 108.076 -175.596 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.62 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.07 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.41 115.156 -176.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68 109.338 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 0.37 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 0.3 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.48 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 0.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 3.97 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 2.9 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 60' ' ' LEU . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 0.64 109.629 178.684 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.63 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 0.78 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 2.16 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 1.86 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.13 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 0.47 112.186 -170.734 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 0.51 109.317 176.451 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 0.51 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.5 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 1.84 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 1.9 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 1.74 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 0.54 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 1.9 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 0.67 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 0.94 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.82 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 2.96 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 0.62 105.774 169.984 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.581 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 0.3 106.192 172.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 0.73 106.464 -177.151 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.89 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 0.93 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.72 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 3.4 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.24 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 0.54 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 2.93 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 0.62 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.05 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.752 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 0.38 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.898 ' HB2' HD21 ' A' ' 67' ' ' LEU . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 2.13 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 0.46 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 22' ' ' VAL . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 0.51 110.527 175.26 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.57 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 3.94 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 0.71 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.54 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 1.76 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 1.38 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 1.9 112.646 172.497 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 4.58 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.88 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -116.18 54.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.19 108.194 163.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 58.15 172.39 0.06 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.661 1.985 . . . . 3.87 113.664 174.456 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.68 73.02 1.58 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.252 -1.018 . . . . 1.96 108.252 178.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 58.17 83.24 0.12 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.738 1.384 . . . . 2.79 114.738 -177.37 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 107.481 -1.303 . . . . 7.39 107.481 130.715 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 119.12 -0.467 . . . . 4.76 110.581 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.83 144.69 45.6 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.824 -0.91 . . . . 1.84 110.824 178.359 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.62 108.14 20.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.434 -1.321 . . . . 1.06 107.434 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.04 128.26 37.81 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 2.65 105.983 175.051 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.745 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 2.01 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 2.33 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.745 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.51 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 1.7 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 2.56 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 1.84 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 2.25 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 0.4 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 0.28 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 0.29 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 4.84 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 2.81 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 60' ' ' LEU . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 0.61 110.106 178.377 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.84 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 2.96 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 0.82 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 1.76 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 1.84 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.66 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 0.53 111.647 -173.419 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 0.52 110.607 177.606 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 0.56 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.61 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 2.37 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 1.84 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.01 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.741 HG12 HD13 ' A' ' 44' ' ' LEU . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 1.74 109.44 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 0.5 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 1.9 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 0.6 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 0.95 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.83 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.1 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.922 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 0.73 106.228 170.278 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 0.46 106.814 170.159 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.922 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 0.7 106.403 -178.767 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.63 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.03 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.84 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 2.77 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.44 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.41 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 0.83 113.16 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.15 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 0.61 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.01 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.688 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 0.73 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.615 ' HA ' HD21 ' A' ' 67' ' ' LEU . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.49 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.03 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 0.7 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 22' ' ' VAL . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 0.56 109.621 175.541 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.02 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 3.59 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 0.9 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.66 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 2.29 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.68 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.615 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 1.71 112.197 176.524 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 6.64 107.031 168.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.67 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -85.68 62.53 7.52 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.93 109.926 168.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 69.73 143.54 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.313 1.445 . . . . 3.82 112.391 168.259 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -80.58 67.0 6.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.278 -0.874 . . . . 2.43 110.115 -177.134 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 80.37 96.37 0.05 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.578 1.151 . . . . 2.73 112.132 -176.599 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.402 0 N-CA-C 102.704 -3.073 . . . . 6.67 102.704 155.308 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 107.318 -1.364 . . . . 4.43 107.318 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -143.49 1.68 Allowed Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.56 -1.416 . . . . 1.22 109.56 168.177 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.7 m -143.69 135.27 26.17 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 120.559 -1.554 . . . . 1.25 107.376 170.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.401 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -92.1 113.37 25.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 3.19 106.078 -173.642 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 1.93 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 1.46 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.685 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.48 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 3.31 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.33 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 1.97 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.38 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.561 ' SD ' HG21 ' A' ' 22' ' ' VAL . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 2.58 111.288 -178.713 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.56 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 0.43 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 0.3 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 0.33 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.23 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 3.58 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.561 HG21 ' SD ' ' A' ' 13' ' ' MET . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 0.39 109.349 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.09 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 0.44 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 2.09 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 3.34 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.74 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 0.55 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 0.46 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.37 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 0.5 111.695 -171.019 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.09 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 1.98 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 2.48 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.94 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.415 HG12 HD13 ' A' ' 44' ' ' LEU . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 1.88 110.198 -175.224 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 0.6 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 1.9 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 0.72 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 0.96 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.06 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 2.77 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.755 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 1.0 105.876 171.686 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.755 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 0.28 105.791 175.855 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.552 HG11 HD11 ' A' ' 52' ' ' ILE . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 0.83 108.415 171.971 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.13 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.12 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.84 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 2.39 106.426 152.0 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.59 107.537 -177.91 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.59 HD13 HG23 ' A' ' 56' ' ' VAL . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 0.58 111.681 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.43 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 0.79 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.16 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.685 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 0.35 109.829 -179.561 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.598 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.07 109.687 -174.433 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.4 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 0.53 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.745 HD22 HD23 ' A' ' 67' ' ' LEU . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 0.57 109.648 172.809 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 4.49 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 4.76 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 0.84 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.74 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 1.78 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 1.78 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.745 HD23 HD22 ' A' ' 60' ' ' LEU . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 2.16 111.653 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 5.09 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.49 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.81 55.33 1.72 Allowed 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.4 110.964 170.169 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 58.85 -178.32 0.08 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 122.458 1.123 . . . . 4.94 112.438 174.892 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -130.48 96.59 4.17 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.259 1.024 . . . . 2.01 108.977 -179.265 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 56.35 43.4 26.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.014 1.326 . . . . 3.0 111.228 176.466 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--O 1.262 1.717 0 N-CA-C 103.77 -2.678 . . . . 7.95 103.77 165.87 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.384 -0.598 . . . . 6.52 109.384 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.01 -168.35 37.2 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.279 0.942 . . . . 2.64 111.482 170.247 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.74 113.86 25.54 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 105.767 -1.938 . . . . 1.46 105.767 -166.612 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.35 140.92 29.03 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 2.62 106.814 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.767 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 1.9 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 1.69 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.767 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.32 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 1.95 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.07 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 2.62 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 2.34 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.56 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.84 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 0.57 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 0.46 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 0.36 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 4.72 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 3.02 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 0.41 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.06 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 2.61 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 0.44 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.519 HG13 HG22 ' A' ' 56' ' ' VAL . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 2.02 111.23 174.684 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 1.69 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 1.34 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 0.54 111.512 -164.382 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 0.52 110.401 178.243 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.48 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 0.42 111.477 -178.323 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.28 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.36 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 2.6 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.62 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.864 HG12 HD13 ' A' ' 44' ' ' LEU . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 1.66 107.1 178.028 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 0.51 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 1.89 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 0.56 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 0.92 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.15 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 3.12 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.864 HD13 HG12 ' A' ' 37' ' ' VAL . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 0.65 105.531 172.043 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.733 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 0.36 101.934 -179.99 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.734 HG23 HD11 ' A' ' 44' ' ' LEU . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 0.9 106.024 171.382 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.35 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 0.9 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.38 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 2.6 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.13 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 0.41 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 2.77 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 0.47 110.34 174.757 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.65 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.628 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 0.47 109.312 177.205 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.512 ' HB2' HD21 ' A' ' 67' ' ' LEU . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 0.89 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 0.38 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 0.39 109.925 174.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.48 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 3.99 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 0.5 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 1.92 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 1.45 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 1.59 112.495 173.14 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 6.39 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -123.04 51.22 1.46 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.33 108.028 170.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 55.63 -179.56 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.738 1.256 . . . . 3.76 111.825 -177.063 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.72 55.09 1.27 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.803 0.841 . . . . 1.89 109.561 -167.106 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 75.95 139.43 0.07 Allowed 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 124.76 1.288 . . . . 2.85 109.332 -157.605 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.222 -1.37 . . . . 7.47 107.589 167.994 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 109.659 -0.496 . . . . 3.96 109.659 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.03 -168.6 13.22 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.486 -0.645 . . . . 1.24 111.486 172.626 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.47 119.14 31.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.738 -1.578 . . . . 1.58 106.738 -173.433 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.54 125.96 43.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 3.07 107.865 -176.683 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.737 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 2.06 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 1.47 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.737 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.37 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 1.98 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.478 HG22 ' HB3' ' A' ' 67' ' ' LEU . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 3.08 110.345 -169.656 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 2.51 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.13 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 2.19 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.81 114.13 -161.143 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.7 108.381 -172.774 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 0.37 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 0.3 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.57 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 0.32 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 4.37 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.0 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 0.42 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.42 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.86 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 0.42 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.523 HG13 HG22 ' A' ' 56' ' ' VAL . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 2.13 111.388 173.063 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 1.76 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.81 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 0.53 112.075 -173.429 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 0.54 109.995 -179.23 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.595 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.48 113.372 -177.037 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 0.47 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.28 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 2.86 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 2.26 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.83 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 1.75 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 0.51 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 1.96 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 0.53 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 0.93 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.84 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 2.22 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 0.85 106.043 173.164 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 0.35 103.391 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 0.73 106.586 175.078 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.14 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 0.92 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 p30 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 3.5 103.208 -163.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.18 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.595 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 0.65 113.181 -169.888 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.11 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 0.56 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.89 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.671 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 0.52 109.551 178.416 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.01 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 0.89 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 0.38 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 0.49 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.56 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 5.48 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 0.73 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.55 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 1.85 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 1.91 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.478 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 2.07 114.421 175.331 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 3.99 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.42 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -118.51 56.55 0.88 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.49 110.391 175.112 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 66.62 -179.45 0.21 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.592 1.157 . . . . 3.71 111.479 165.449 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -106.17 64.87 0.68 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.941 0.896 . . . . 1.96 108.859 175.351 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 60.22 54.21 4.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.889 0.876 . . . . 2.66 111.773 -177.243 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.255 1.382 0 N-CA-C 104.819 -2.289 . . . . 7.95 104.819 171.548 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 4.88 108.73 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 1.33 107.697 -175.751 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 1.02 107.035 173.937 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.78 112.76 175.142 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 1.94 107.077 174.166 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.64 111.751 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.83 102.189 151.753 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 4.88 108.73 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 1.33 107.697 -175.751 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 1.02 107.035 173.937 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 179.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.78 112.76 175.142 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 1.94 107.077 174.166 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.64 111.751 179.168 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.83 102.189 151.753 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 2.59 107.123 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.85 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 1.85 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 1.7 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.85 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.47 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 1.7 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG11 ' SD ' ' A' ' 13' ' ' MET . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.21 113.224 -161.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 1.73 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.41 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.479 ' SD ' HG21 ' A' ' 22' ' ' VAL . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 2.17 111.152 -177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.41 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 0.33 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 0.25 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.554 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56 108.087 172.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 0.31 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 5.74 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 2.87 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 0.54 108.247 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.06 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.7 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 0.57 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.426 ' CG1' HG13 ' A' ' 56' ' ' VAL . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 1.92 109.865 175.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 3.71 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.17 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 0.57 112.092 -170.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 0.36 110.641 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.32 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.452 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 0.36 111.979 -175.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.04 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 1.77 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 2.43 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.88 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 1.84 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 0.56 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 1.98 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 0.55 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 0.92 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.1 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.05 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 0.76 106.792 170.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.662 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 0.44 105.168 174.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.539 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 0.59 107.635 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.82 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 0.83 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.53 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 2.5 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.05 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 0.45 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 7.77 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' ' CG ' ' A' ' 57' ' ' GLU . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 0.81 111.792 173.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.22 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.727 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 0.34 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.559 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.67 108.451 -167.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 1.52 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 0.41 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.697 HD22 HD13 ' A' ' 67' ' ' LEU . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 0.42 110.965 176.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.49 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 2.98 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 0.65 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.53 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 1.86 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.34 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.697 HD13 HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 1.91 110.999 168.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 3.45 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.4 110.622 170.816 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? . . . . . 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 3.34 106.052 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.806 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 2.05 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 1.99 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.806 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.27 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 1.72 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 11' ' ' SER . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 1.92 110.128 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 10' ' ' VAL . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.1 105.533 169.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.08 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.08 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 1.65 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 0.99 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 0.45 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.07 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 0.6 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 4.23 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.33 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 0.43 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.83 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 2.87 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 0.57 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.516 HG13 HG22 ' A' ' 56' ' ' VAL . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 2.27 111.016 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.27 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.21 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 0.87 111.836 -171.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 0.6 109.722 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.57 113.477 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 0.42 111.802 -169.321 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.19 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 1.62 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 2.68 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 1.79 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 1.89 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 3.33 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 1.72 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.47 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.18 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.15 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 0.88 106.644 176.476 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.8 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 0.4 105.288 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.929 HG23 HD11 ' A' ' 44' ' ' LEU . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 0.71 107.236 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.43 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.504 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 0.86 112.086 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.49 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 3.29 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.417 ' O ' HG23 ' A' ' 52' ' ' ILE . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.85 111.05 166.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 0.43 112.181 -174.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 2.38 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 0.5 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.57 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.644 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 0.36 108.772 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HB2' HD11 ' A' ' 67' ' ' LEU . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.06 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 0.35 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' HD23 ' A' ' 67' ' ' LEU . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 0.39 111.012 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.5 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.03 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 0.52 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 1.91 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 1.5 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 2.08 111.889 -178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.33 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.83 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? . . . . . 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 2.79 109.163 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.74 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 1.97 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 1.52 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.74 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.38 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 1.97 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 2.52 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.21 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.22 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 2.22 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.39 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.7 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 0.36 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 0.26 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.44 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 0.3 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.26 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 3.87 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 60' ' ' LEU . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 0.45 109.946 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.11 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.87 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 0.45 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.95 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 1.7 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.79 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 0.44 112.013 -171.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 0.4 109.737 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 0.3 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 0.91 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 2.56 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 2.07 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.92 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 1.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 0.6 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 1.98 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 0.72 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 0.95 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.12 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 2.77 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 0.75 107.503 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 0.42 106.233 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.594 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 0.61 107.397 -174.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.14 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 0.85 109.058 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.64 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 3.52 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.44 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 0.37 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 2.62 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 0.4 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.89 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.615 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 0.33 109.616 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.582 ' HA ' HD21 ' A' ' 67' ' ' LEU . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.42 108.691 -169.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 1.96 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 0.31 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 0.47 110.737 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.31 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 4.42 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 0.51 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 1.94 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 1.86 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 2.1 111.401 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 3.49 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.39 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 2.4 107.452 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.794 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 2.11 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 1.8 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.794 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.31 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 2.22 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 12' ' ' GLY . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 2.45 111.135 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.23 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 10' ' ' VAL . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.05 105.306 175.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.26 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.69 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 0.36 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 0.28 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.47 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 0.39 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 5.16 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 2.62 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 0.55 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.83 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.66 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 0.62 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 2.11 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 1.91 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.07 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 0.6 110.938 -171.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 0.49 109.143 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.55 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.412 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 0.39 112.045 -172.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 0.99 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 1.73 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 2.66 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.63 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 1.76 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 0.55 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 1.81 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 0.61 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 1.2 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.53 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 3.13 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.782 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 0.8 104.894 172.164 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.746 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 0.39 105.313 172.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.782 HG23 HD11 ' A' ' 44' ' ' LEU . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 0.7 107.633 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.66 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.616 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 0.79 110.494 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.41 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 3.56 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.03 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.426 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 0.46 112.722 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 2.88 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 0.46 111.176 172.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.86 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.738 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 0.38 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.557 ' HB2' HD11 ' A' ' 67' ' ' LEU . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.41 110.233 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.01 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 0.42 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.554 ' CD2' HD23 ' A' ' 67' ' ' LEU . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 0.46 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.44 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 2.9 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 0.72 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.51 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 2.05 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 1.64 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' ' 57' ' ' GLU . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 2.02 113.02 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 3.54 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.61 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7 109.622 164.288 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 3.36 107.624 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.674 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 2.42 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 1.49 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.674 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.45 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 2.76 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 2.63 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 1.72 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.41 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 2.11 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.19 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.71 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 0.4 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 0.25 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.49 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 0.34 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 3.77 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 3.14 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.478 HG13 HD11 ' A' ' 60' ' ' LEU . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 0.4 109.345 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.67 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.11 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 0.45 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 2.16 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.04 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.7 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 0.41 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 0.38 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.32 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 0.37 112.061 -169.46 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 0.99 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 2.11 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 2.21 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.87 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.838 HG12 HD13 ' A' ' 44' ' ' LEU . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 1.55 106.58 171.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 0.76 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 1.85 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 0.9 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 0.98 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.47 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 3.45 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD13 HG12 ' A' ' 37' ' ' VAL . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 0.71 104.312 172.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.633 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 0.31 103.189 -176.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 52' ' ' ILE . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 0.71 107.398 176.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.443 ' HB3' ' CE2' ' A' ' 6' ' ' TYR . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 0.72 111.023 -172.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.37 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 2.53 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.35 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.558 HD11 HG11 ' A' ' 46' ' ' VAL . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 0.5 111.382 -175.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.41 109.771 -164.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 0.49 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.68 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.658 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 0.39 109.116 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.06 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 0.38 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 HD23 ' A' ' 67' ' ' LEU . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 0.43 110.423 174.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.49 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 2.91 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 0.57 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 1.99 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 1.61 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 2.08 114.132 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 4.26 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.81 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.41 108.14 162.363 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 2.68 106.268 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.757 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 1.91 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 1.69 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.37 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 4.06 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 1.93 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 2.43 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.08 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.269 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.269 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 0.35 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 0.25 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 0.24 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.12 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 2.42 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 0.47 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.36 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 0.44 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CG2' HG13 ' A' ' 56' ' ' VAL . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 2.08 111.112 170.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 1.81 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.09 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 0.5 111.45 -173.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 0.39 110.382 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.35 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 0.35 112.286 -173.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.15 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 1.81 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 2.5 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.63 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 2.92 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 0.57 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 1.94 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 0.59 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 0.97 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.02 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 2.79 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 45' ' ' VAL 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 0.86 104.448 -176.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.512 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 0.3 104.61 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.434 HG11 HD11 ' A' ' 52' ' ' ILE . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 0.72 107.246 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.4 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 0.67 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.34 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 2.43 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.16 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.434 HD11 HG11 ' A' ' 46' ' ' VAL . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 0.38 111.729 -177.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.34 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 0.69 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.78 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.725 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 0.43 109.932 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.685 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1 109.544 -172.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 0.92 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 0.37 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 0.54 110.365 176.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.46 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 2.86 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 0.47 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 1.86 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 1.39 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.685 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 1.68 112.6 176.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.09 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.8 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.34 110.217 177.693 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 2.87 105.172 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.836 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 1.99 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 1.54 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.836 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.41 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 1.61 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.436 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.11 112.542 -163.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.05 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.512 ' SD ' HG21 ' A' ' 22' ' ' VAL . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.14 112.299 -170.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 0.39 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 0.37 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 0.37 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 3.39 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 2.43 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' CYS . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 0.42 108.684 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.9 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 0.44 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.595 HG13 HG22 ' A' ' 56' ' ' VAL . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 2.24 111.434 176.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.05 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.86 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 0.59 111.548 -172.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 0.44 111.175 -177.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.42 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 0.36 111.319 -175.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.31 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 2.07 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 2.11 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.49 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.529 HG12 HD13 ' A' ' 44' ' ' LEU . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 1.56 109.302 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 0.59 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 1.84 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 0.63 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.03 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.64 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 2.26 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.884 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 0.55 105.123 172.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.706 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 0.43 106.499 173.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.884 HG23 HD11 ' A' ' 44' ' ' LEU . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 0.73 108.457 178.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.31 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.56 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 2.64 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.87 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.502 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 0.41 111.298 175.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 3.57 111.775 -176.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 0.49 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 0.37 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.742 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.43 110.482 -175.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 0.92 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 0.31 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 0.45 110.212 174.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.49 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.01 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 0.48 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 22' ' ' VAL . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 1.89 110.942 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 2.91 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.742 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 1.86 113.609 174.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.29 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.57 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.36 110.2 171.702 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 2.39 107.457 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.704 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 1.94 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 1.71 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.704 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.44 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 1.79 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.12 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.0 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.36 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 2.22 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.61 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 0.35 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 0.33 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.535 ' O ' HG23 ' A' ' 22' ' ' VAL . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.49 109.046 172.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 0.26 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 3.85 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 2.37 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 18' ' ' CYS . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 0.55 109.838 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.85 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 2.82 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 0.48 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.771 HG22 HG11 ' A' ' 32' ' ' VAL . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 2.57 110.679 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 1.94 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 0.92 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 1.16 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 0.59 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.453 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.48 113.269 -170.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.771 HG11 HG22 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 0.35 110.841 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 0.95 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 1.99 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 2.13 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.62 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.749 HG12 HD13 ' A' ' 44' ' ' LEU . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 1.64 106.412 173.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 0.55 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 1.94 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 0.52 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 0.97 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.61 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 2.87 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 0.65 105.429 175.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.781 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 0.37 103.065 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.595 HG23 HD11 ' A' ' 44' ' ' LEU . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 0.85 107.292 171.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.12 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 0.92 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 3.26 104.312 -170.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 0.62 113.932 -177.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 2.78 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.443 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 0.44 111.011 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.24 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 26' ' ' VAL . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 0.67 108.582 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 1.09 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 0.33 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 67' ' ' LEU . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 0.49 110.633 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.49 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 2.69 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 0.45 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.43 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 2.0 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 2.62 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 60' ' ' LEU 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 1.72 113.563 179.934 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 3.27 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.72 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 . . . . . 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 3.3 107.607 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.594 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 2.19 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 1.48 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.742 ' CE3' HG11 ' A' ' 56' ' ' VAL . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.47 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 2.8 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 2.66 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.07 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.43 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.01 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.257 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.59 113.649 -174.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.257 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.74 108.96 -168.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 0.44 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 0.26 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 0.3 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 3.62 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 2.58 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.735 HG13 HD11 ' A' ' 60' ' ' LEU . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 0.4 110.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.86 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 2.37 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 0.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 56' ' ' VAL . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 1.86 111.201 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 3.97 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 0.95 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 55' ' ' GLN . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 0.64 112.103 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 0.52 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.38 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.438 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 0.46 110.909 -173.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.17 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 2.27 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 2.14 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.43 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.662 HG12 HD13 ' A' ' 44' ' ' LEU . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 1.68 107.706 175.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 0.53 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 2.18 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 0.54 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.15 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.57 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 2.7 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.762 HD12 ' N ' ' A' ' 45' ' ' VAL 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 0.59 105.07 177.688 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.762 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 0.29 104.551 -179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 0.99 105.204 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.03 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.62 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 2.42 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.3 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.605 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 0.48 111.699 -176.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 2.8 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 0.43 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB3' HD13 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.08 110.592 174.366 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.742 HG11 ' CE3' ' A' ' 8' ' ' TRP . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 0.44 109.394 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 67' ' ' LEU . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.94 110.509 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 0.84 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 0.47 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.735 HD11 HG13 ' A' ' 22' ' ' VAL . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 0.49 111.207 175.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.61 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 3.61 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 0.58 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.47 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 2.1 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 2.12 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.591 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 2.02 111.457 -178.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 3.44 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.413 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.12 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.02 109.032 164.675 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 2.37 106.901 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 1.9 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 1.89 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.37 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 2.62 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 1.82 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.02 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.36 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 2.12 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.71 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 0.41 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 0.28 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45 108.695 172.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 0.34 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 3.44 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 3.21 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 18' ' ' CYS . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 0.43 108.906 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.12 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.9 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 0.41 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.457 ' CG1' HG13 ' A' ' 56' ' ' VAL . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 1.87 111.242 170.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 1.83 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.27 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 0.46 112.606 -169.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 0.49 111.011 -176.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.37 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 0.45 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.08 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 2.32 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 1.98 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.26 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 1.68 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 0.52 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 2.01 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 0.7 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.3 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.47 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 2.63 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 0.81 105.734 175.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 0.59 105.324 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.492 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 0.81 106.05 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.92 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 0.72 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.74 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 2.48 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.43 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.492 HD11 HG11 ' A' ' 46' ' ' VAL . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 0.42 110.773 -178.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 2.65 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 0.61 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.41 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.775 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 0.35 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.439 ' HB2' HD21 ' A' ' 67' ' ' LEU . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.81 109.915 -176.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.13 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 0.4 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.622 HD22 HD13 ' A' ' 67' ' ' LEU . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 0.52 110.643 176.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.53 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 2.86 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 0.6 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.6 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 1.97 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 1.43 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.622 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 1.59 112.876 175.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 3.33 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.19 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.86 109.34 161.756 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 2.68 106.854 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.756 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 2.09 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 1.59 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.44 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 2.41 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.06 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 1.75 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.43 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 2.54 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.6 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 0.34 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 0.27 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 0.25 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 3.54 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 2.57 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 HD11 ' A' ' 60' ' ' LEU . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 0.55 109.862 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.26 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.76 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 0.55 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.465 ' CG1' HG13 ' A' ' 56' ' ' VAL . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 1.8 110.333 171.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 1.73 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 0.81 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 0.4 111.966 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 0.39 110.569 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.35 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 0.35 111.467 -172.489 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.09 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 1.99 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 2.07 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.61 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 44' ' ' LEU . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 1.69 108.526 174.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 0.51 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 1.81 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 0.57 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 0.98 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.12 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 2.31 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 0.72 107.01 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.653 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 0.41 106.842 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.566 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 0.82 105.769 -173.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 0.73 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 2.45 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.35 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 0.49 112.985 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.07 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 0.57 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.38 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.678 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 0.37 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HB2' HD21 ' A' ' 67' ' ' LEU . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.24 109.654 -171.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 0.87 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 0.48 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.658 HD22 HD13 ' A' ' 67' ' ' LEU . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 0.48 109.404 175.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 4.16 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 2.76 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 0.55 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 1.87 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.2 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.658 HD13 HD22 ' A' ' 60' ' ' LEU 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 1.77 111.239 168.417 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 5.59 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.45 107.859 172.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 2.85 106.887 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.756 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 2.38 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 1.58 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.38 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 1.67 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HE3' ' A' ' 13' ' ' MET . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.09 112.917 -166.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.1 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.56 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.554 ' HE3' HG21 ' A' ' 10' ' ' VAL . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 2.6 112.936 -175.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.41 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 0.55 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 0.38 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.464 ' O ' HG23 ' A' ' 22' ' ' VAL . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.72 108.655 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 0.32 111.643 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 3.88 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.09 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HE2' ' A' ' 13' ' ' MET . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 0.4 108.566 175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.36 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.08 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 0.54 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 1.95 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 2.25 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.85 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 0.44 112.571 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 0.38 111.308 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.446 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 0.43 111.371 -173.121 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 0.93 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 1.7 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 2.34 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.87 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.579 HG22 HD13 ' A' ' 44' ' ' LEU . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 2.33 108.177 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 0.69 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 2.03 110.502 172.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 0.54 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 1.09 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.49 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 2.35 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 0.78 106.229 174.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.72 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 0.3 104.867 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.67 HG23 HD11 ' A' ' 44' ' ' LEU . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 0.88 106.403 -179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.45 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 0.7 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.64 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 2.5 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.402 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 0.48 112.675 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 2.92 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 0.57 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.15 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.668 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 0.32 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.01 110.073 -174.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 0.92 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 0.32 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.456 HD11 HG13 ' A' ' 22' ' ' VAL . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 0.56 110.635 176.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.46 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.28 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 0.46 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 1.86 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.54 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 57' ' ' GLU 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 1.72 113.246 172.826 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 3.96 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.23 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 2.62 106.934 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.868 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 2.2 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 1.42 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.868 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.29 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 1.65 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.04 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 1.8 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.34 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.07 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.58 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 0.37 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 0.38 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 0.36 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 3.54 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 2.45 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 60' ' ' LEU . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 0.7 109.649 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.06 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.03 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 0.54 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 2.01 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.03 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 0.89 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 0.55 112.045 -170.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 0.4 110.721 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.39 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 0.35 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.04 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 1.99 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 1.94 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.15 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.735 HG12 HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 1.81 108.586 -179.332 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 0.58 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 2.02 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 0.58 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 0.96 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.11 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.12 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 0.84 106.008 173.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.785 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 0.36 106.626 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.772 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 0.74 107.356 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.12 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 0.63 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.22 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 40.0 t30 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 2.42 102.759 172.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.425 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 0.48 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 2.85 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 0.58 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.602 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 0.34 109.841 175.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.09 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.08 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 0.46 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 22' ' ' VAL . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 0.47 110.183 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.57 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 2.96 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 0.5 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.49 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 1.9 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 1.62 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 2.11 112.567 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.29 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.11 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 . . . . . 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.39 108.542 167.907 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 3.6 106.314 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 2.16 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 1.43 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.61 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 1.56 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 2.97 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 1.73 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 5.18 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.67 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 0.38 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 0.47 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 0.3 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.3 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 2.62 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 0.79 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.07 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.76 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 0.61 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 1.79 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 1.83 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.05 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 0.64 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 0.52 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.49 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 0.46 110.98 -173.554 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 0.96 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 2.32 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 1.84 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.611 HG22 HD13 ' A' ' 44' ' ' LEU . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 2.39 108.118 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 0.53 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 1.84 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 0.67 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 2.64 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.02 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.15 110.949 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.611 HD13 HG22 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 0.9 104.109 -175.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.582 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 0.29 107.087 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 0.62 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 0.7 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.61 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 2.54 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.51 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 0.83 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.24 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 0.55 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.56 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 0.85 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HA ' HD21 ' A' ' 67' ' ' LEU . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.89 107.799 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.14 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 0.91 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 0.76 110.017 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.78 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 3.64 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.31 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.16 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 2.52 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 1.86 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.623 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 1.82 110.524 165.241 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 4.4 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.12 108.647 168.702 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 2.37 105.544 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.795 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 2.01 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 1.59 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.795 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.39 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 1.86 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 1.81 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 2.77 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.31 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HG2' HG21 ' A' ' 22' ' ' VAL . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.23 113.072 -174.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.37 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 0.34 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 0.31 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.555 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51 109.128 172.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 0.28 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.07 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 4.13 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 0.55 108.981 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.33 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.89 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 0.44 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 56' ' ' VAL . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 2.16 111.071 171.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.09 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.82 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 0.55 111.561 -174.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 0.33 110.877 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.31 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 0.38 111.459 -174.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.19 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 1.81 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 2.36 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.47 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 2.85 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 0.52 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 1.84 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 0.55 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.3 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.14 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.57 HD12 ' N ' ' A' ' 45' ' ' VAL 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 0.92 105.048 -178.669 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.57 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 0.32 104.73 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 52' ' ' ILE . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 0.76 106.798 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.08 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 0.94 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.61 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 2.51 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.09 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.494 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 0.4 110.904 -174.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.37 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 0.63 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.85 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 0.4 110.141 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.535 ' HA ' HD21 ' A' ' 67' ' ' LEU . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.92 108.816 -173.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.25 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 0.44 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.431 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 0.59 111.756 178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 1.54 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 3.74 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 0.56 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.48 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.464 ' CE2' HG22 ' A' ' 22' ' ' VAL . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 1.84 109.265 174.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 1.66 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 2.01 111.218 -177.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 4.27 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.16 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.85 108.582 170.902 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 108.963 -0.754 . . . . 2.76 108.963 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.774 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 2.06 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 1.61 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.774 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.35 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 1.96 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.03 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 1.79 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.42 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.14 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.42 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 0.35 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 0.26 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 0.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 3.44 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 2.78 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.446 HG13 HD11 ' A' ' 60' ' ' LEU . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 0.68 110.467 -172.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.83 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.59 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 0.52 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 HG13 ' A' ' 56' ' ' VAL . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 1.82 110.606 170.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 3.26 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 0.89 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 0.44 112.273 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 0.35 110.631 -178.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.32 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 0.33 112.258 -169.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.06 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 2.4 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 1.97 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.35 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.653 HG12 HD13 ' A' ' 44' ' ' LEU . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 1.77 108.697 177.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 0.66 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 1.88 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 0.86 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 1.33 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.27 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 2.34 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 0.66 105.3 -179.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.671 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 0.4 105.942 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 0.68 106.477 -178.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.26 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.62 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 2.6 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.32 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.507 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 0.39 113.635 176.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 2.88 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 0.56 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.19 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.697 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 0.34 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.713 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 0.95 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 0.39 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 HD13 ' A' ' 67' ' ' LEU . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 0.61 110.218 173.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.48 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 3.49 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 0.54 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.45 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 1.85 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 1.37 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.713 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 1.86 113.019 171.131 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.22 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.07 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.51 110.821 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 2.95 106.502 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.83 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 2.05 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.15 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.83 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.37 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 1.66 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.01 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 2.96 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.74 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 2.47 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.56 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.74 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 0.55 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 0.35 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.609 ' O ' HG23 ' A' ' 22' ' ' VAL . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 0.38 111.042 175.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 3.42 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 3.59 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 18' ' ' CYS . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 0.51 108.423 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.85 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 2.75 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 0.52 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.46 ' CG1' HG13 ' A' ' 56' ' ' VAL . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 1.87 110.039 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 3.71 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 0.83 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 0.48 112.226 -171.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 0.53 109.501 178.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 0.48 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 0.98 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 2.65 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 2.43 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.3 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.694 HG22 HD13 ' A' ' 44' ' ' LEU . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 2.23 107.742 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 0.68 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 1.95 110.527 172.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 0.65 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 1.28 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.12 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.06 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.694 HD13 HG22 ' A' ' 37' ' ' VAL 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 0.77 104.231 178.48 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.67 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 0.32 105.226 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG11 HD11 ' A' ' 52' ' ' ILE . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 0.6 106.203 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.37 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.19 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.84 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 3.51 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.28 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.561 HD11 HG11 ' A' ' 46' ' ' VAL . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 0.47 114.412 178.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.442 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 2.7 112.617 173.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 0.81 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.01 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 0.33 109.728 -174.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.524 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.11 109.892 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 0.86 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 0.32 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.45 ' CD2' HD23 ' A' ' 67' ' ' LEU . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 0.5 110.423 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.48 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.11 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 0.49 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 1.86 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 1.55 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.525 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 2.07 112.941 179.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 4.32 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.87 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.93 109.574 170.339 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 3.44 103.846 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 2.15 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 1.58 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.36 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 1.64 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 2.49 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 1.85 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.57 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 2.58 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 0.35 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 0.31 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 0.47 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 3.7 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 3.66 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 18' ' ' CYS . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 0.51 110.001 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.82 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.07 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 0.41 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.541 ' CG2' HG13 ' A' ' 56' ' ' VAL . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 2.15 111.167 176.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 1.84 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 0.84 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 0.42 112.586 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 0.39 110.782 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.34 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 0.31 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.04 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 1.86 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 2.3 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.89 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.599 HG22 HD13 ' A' ' 44' ' ' LEU . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.55 107.839 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 0.6 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 1.92 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 0.71 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 1.43 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.39 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 2.28 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.599 HD13 HG22 ' A' ' 37' ' ' VAL 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 0.83 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.44 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 0.35 105.571 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 52' ' ' ILE . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 0.7 108.047 177.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.26 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 0.67 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.51 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 2.57 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.13 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.513 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 0.42 111.758 173.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.0 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 0.41 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.45 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.666 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 0.35 109.613 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.774 ' HB2' HD21 ' A' ' 67' ' ' LEU . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.07 109.689 -168.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 0.89 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 0.48 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 0.69 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.49 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 3.43 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 0.48 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.45 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.47 ' CE2' HG22 ' A' ' 22' ' ' VAL . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 2.24 110.152 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 1.67 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.774 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 1.83 114.74 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 4.09 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.97 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.42 108.634 169.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 2.4 107.479 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 1.9 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 1.86 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.717 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.43 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 2.99 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 11' ' ' SER . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.08 109.851 -178.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.437 ' H ' HG22 ' A' ' 10' ' ' VAL . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.15 106.113 169.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.4 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.16 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.42 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 0.26 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.47 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 0.31 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 4.74 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 2.92 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 0.38 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.15 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.67 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 0.43 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.431 HG13 HG22 ' A' ' 56' ' ' VAL . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 2.15 110.728 175.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 2.75 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.77 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 0.45 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 0.4 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.535 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.43 113.455 -171.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 0.54 110.927 -177.449 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 0.93 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 1.7 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 2.44 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.22 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 1.59 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 0.68 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 2.06 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 0.68 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.14 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.78 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 2.96 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 0.74 104.818 173.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.769 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 0.38 106.237 176.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.736 HG23 HD11 ' A' ' 44' ' ' LEU . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 0.78 107.25 -171.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.31 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 0.7 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.14 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 3.63 103.797 -170.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.53 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.535 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 0.53 113.378 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.415 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 2.55 111.061 -170.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 0.58 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.717 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 0.4 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HG3' HD13 ' A' ' 67' ' ' LEU . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.44 107.886 -174.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 0.84 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 0.42 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 0.55 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.57 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 5.5 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 0.88 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 1.97 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 1.84 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 2.13 113.345 177.357 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.26 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.59 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.85 109.109 172.709 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.442 -0.857 0 N-CA-C 108.044 -1.095 . . . . 2.56 108.044 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.656 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 2.1 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 1.47 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.678 ' CE3' HG11 ' A' ' 56' ' ' VAL . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.38 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 2.13 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 11' ' ' SER . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 2.26 109.944 -172.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' HG22 ' A' ' 10' ' ' VAL . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 2.71 108.925 169.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.12 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 2.38 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.003 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.003 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.6 110.457 -171.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 0.34 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 0.31 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.47 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 0.25 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 5.26 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 2.65 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.439 HG13 HD11 ' A' ' 60' ' ' LEU . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 0.39 108.333 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.82 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 0.61 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG11 HG13 ' A' ' 56' ' ' VAL . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 1.97 110.671 170.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 1.67 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 0.92 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 0.53 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 0.53 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.37 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 0.48 110.932 -171.289 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 0.97 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 2.14 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 2.27 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 1.72 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 0.8 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 1.87 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 0.58 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 1.01 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.35 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 2.34 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 0.91 106.003 177.691 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 0.54 103.516 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.564 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 0.93 105.018 -176.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.38 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 0.89 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.39 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 3.66 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.37 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.452 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 0.59 111.827 -171.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.22 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 0.58 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.93 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' CE3' ' A' ' 8' ' ' TRP . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 0.44 108.849 176.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.827 ' HB2' HD21 ' A' ' 67' ' ' LEU . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.69 111.265 -173.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.31 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 0.48 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD22 HD13 ' A' ' 67' ' ' LEU . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 0.63 110.872 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.47 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 2.78 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 0.53 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.59 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 1.96 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 2.21 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 1.83 113.674 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.27 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.58 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.53 110.511 -169.247 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 2.64 107.765 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.906 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 2.51 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 1.95 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.906 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.28 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 2.16 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.484 HG21 ' HE3' ' A' ' 13' ' ' MET . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 1.83 113.754 -171.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.17 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.43 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.491 ' CE ' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 3.01 112.896 -163.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.18 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.38 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 0.34 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.49 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 0.34 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 4.63 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 4.07 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG11 ' CE ' ' A' ' 13' ' ' MET . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 0.38 109.045 178.863 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.9 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.72 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.47 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 56' ' ' VAL . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 1.87 111.536 172.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.01 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 0.88 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 0.44 112.115 -169.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 0.36 110.645 -178.15 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.35 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 0.35 112.117 -169.486 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.01 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 2.06 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 2.14 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 2.39 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 0.5 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 1.86 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 0.58 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.19 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.36 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 3.22 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 0.64 104.916 174.495 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 0.44 103.666 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.593 HG23 HD11 ' A' ' 44' ' ' LEU . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 0.86 106.537 -178.285 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.13 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.05 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.57 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 2.48 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.16 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.414 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 0.48 113.473 176.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 2.85 112.64 179.112 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 0.63 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.07 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.673 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 0.33 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.15 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 0.99 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 0.3 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.679 HD22 HD23 ' A' ' 67' ' ' LEU . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 0.45 110.116 175.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.55 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 3.79 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 0.77 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 1.87 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 1.6 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.679 HD23 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 2.13 113.112 174.28 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 4.56 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.72 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.63 110.009 166.787 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 3.54 107.076 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.882 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 2.24 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 1.65 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.882 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.58 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 1.96 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 3.06 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.4 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.01 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 7.49 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.81 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.099 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 0.85 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 0.83 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 1.099 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.36 107.023 173.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 0.52 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 6.31 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 3.33 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 0.53 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.84 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 2.79 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 0.52 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 56' ' ' VAL . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 2.15 111.139 175.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 1.73 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 0.88 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 0.64 112.121 -170.086 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 0.58 109.8 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.539 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.56 114.33 -177.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 0.35 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.18 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 2.62 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 2.24 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.84 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 2.21 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 0.5 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 1.85 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 0.66 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.18 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.67 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 2.61 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.7 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 0.72 105.629 177.573 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.7 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 0.43 106.58 171.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 0.71 108.401 171.333 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 0.75 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.3 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 3.09 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 52' ' ' ILE . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.47 111.457 171.674 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.539 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 0.52 112.675 -174.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.08 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.49 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.11 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.688 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 0.4 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HA ' HD21 ' A' ' 67' ' ' LEU 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.86 109.045 -166.584 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 1.86 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 0.33 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.811 HD22 HD13 ' A' ' 67' ' ' LEU . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 0.46 110.912 176.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.5 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 3.59 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 0.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 2.0 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.54 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.811 HD13 HD22 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 1.77 113.212 176.783 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 6.37 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.74 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.93 109.547 165.506 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 3.13 108.614 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.82 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 1.87 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 1.53 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.82 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.4 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 1.65 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 1.94 112.02 -161.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 1.87 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.31 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.425 ' SD ' HG11 ' A' ' 10' ' ' VAL . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 2.47 112.643 -166.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.42 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.62 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 0.41 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 0.31 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 0.33 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.13 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.08 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 0.43 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 0.45 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.431 ' CG1' HG13 ' A' ' 56' ' ' VAL . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 1.73 110.945 174.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 1.79 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.7 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 0.49 112.359 -170.249 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 0.5 110.789 -176.345 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.44 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 0.48 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.07 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 1.85 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 2.58 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.66 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 1.81 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 0.63 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 1.83 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.34 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 2.32 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 3.07 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD12 ' H ' ' A' ' 45' ' ' VAL . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 0.76 103.609 168.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.52 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 0.33 103.775 176.512 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.499 HG23 HD11 ' A' ' 44' ' ' LEU . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 0.6 106.971 -177.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.12 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 0.81 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.36 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 2.63 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.11 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.465 HD13 HG23 ' A' ' 56' ' ' VAL . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 0.42 108.672 173.133 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 2.88 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.63 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.17 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.752 HG11 ' HZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 0.38 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.65 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.06 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 0.39 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.685 HD22 HD13 ' A' ' 67' ' ' LEU . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 0.46 110.322 173.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.47 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 2.76 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 0.49 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.61 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 1.93 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.12 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.685 HD13 HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 1.77 113.763 172.764 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 3.45 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.35 108.948 167.089 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 2.83 106.429 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.772 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 2.08 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 1.68 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.772 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.47 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 2.09 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.559 HG22 ' H ' ' A' ' 11' ' ' SER . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 1.7 109.559 -168.021 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.559 ' H ' HG22 ' A' ' 10' ' ' VAL . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 2.8 108.076 -175.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.62 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.07 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.252 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.41 115.156 -176.465 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.252 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68 109.338 -167.58 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 0.37 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 0.3 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.48 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 0.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 3.97 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 2.9 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 60' ' ' LEU . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 0.64 109.629 178.684 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.63 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 0.78 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 2.16 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 1.86 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.13 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 0.47 112.186 -170.734 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 0.51 109.317 176.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 0.51 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.5 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 1.84 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 1.9 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 1.74 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 0.54 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 1.9 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 0.67 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 0.94 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.82 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 2.96 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 0.62 105.774 169.984 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.581 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 0.3 106.192 172.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 0.73 106.464 -177.151 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.89 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 0.93 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.72 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 3.4 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.24 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 0.54 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 2.93 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 0.62 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.05 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.752 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 0.38 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.898 ' HB2' HD21 ' A' ' 67' ' ' LEU . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 2.13 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 0.46 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 22' ' ' VAL . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 0.51 110.527 175.26 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.57 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 3.94 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 0.71 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.54 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 1.76 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 1.38 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 1.9 112.646 172.497 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 4.58 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.88 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 . . . . . 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.19 108.194 163.988 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 2.65 105.983 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.745 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 2.01 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 2.33 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.745 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.51 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 1.7 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 2.56 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 1.84 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 2.25 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 0.4 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 0.28 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 0.29 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 4.84 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 2.81 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 60' ' ' LEU . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 0.61 110.106 178.377 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.84 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 2.96 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 0.82 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 1.76 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 1.84 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.66 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 0.53 111.647 -173.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 0.52 110.607 177.606 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 0.56 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.61 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 2.37 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 1.84 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.01 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.741 HG12 HD13 ' A' ' 44' ' ' LEU . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 1.74 109.44 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 0.5 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 1.9 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 0.6 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 0.95 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.83 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.1 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.922 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 0.73 106.228 170.278 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 0.46 106.814 170.159 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.922 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 0.7 106.403 -178.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.63 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.03 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.84 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 2.77 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.44 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.41 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 0.83 113.16 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.15 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 0.61 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.01 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.688 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 0.73 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.615 ' HA ' HD21 ' A' ' 67' ' ' LEU . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.49 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.03 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 0.7 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 22' ' ' VAL . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 0.56 109.621 175.541 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.02 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 3.59 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 0.9 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.66 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 2.29 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.68 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.615 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 1.71 112.197 176.524 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 6.64 107.031 168.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.67 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 . . . . . 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.93 109.926 168.926 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.401 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 3.19 106.078 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 1.93 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 1.46 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.685 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.48 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 3.31 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.33 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 1.97 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.38 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.561 ' SD ' HG21 ' A' ' 22' ' ' VAL . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 2.58 111.288 -178.713 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.56 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 0.43 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 0.3 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 0.33 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.23 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 3.58 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.561 HG21 ' SD ' ' A' ' 13' ' ' MET . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 0.39 109.349 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.09 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 0.44 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 2.09 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 3.34 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.74 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 0.55 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 0.46 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.37 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 0.5 111.695 -171.019 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.09 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 1.98 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 2.48 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.94 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.415 HG12 HD13 ' A' ' 44' ' ' LEU . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 1.88 110.198 -175.224 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 0.6 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 1.9 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 0.72 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 0.96 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.06 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 2.77 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.755 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 1.0 105.876 171.686 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.755 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 0.28 105.791 175.855 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.552 HG11 HD11 ' A' ' 52' ' ' ILE . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 0.83 108.415 171.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.13 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.12 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.84 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.483 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 2.39 106.426 152.0 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.483 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.59 107.537 -177.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.59 HD13 HG23 ' A' ' 56' ' ' VAL . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 0.58 111.681 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.43 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 0.79 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.16 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.685 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 0.35 109.829 -179.561 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.598 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.07 109.687 -174.433 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.4 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 0.53 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.745 HD22 HD23 ' A' ' 67' ' ' LEU . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 0.57 109.648 172.809 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 4.49 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 4.76 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 0.84 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.74 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 1.78 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 1.78 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.745 HD23 HD22 ' A' ' 60' ' ' LEU . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 2.16 111.653 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 5.09 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.49 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.4 110.964 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 2.62 106.814 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.767 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 1.9 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 1.69 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.767 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.32 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 1.95 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.07 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 2.62 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 2.34 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.56 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.84 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 0.57 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 0.46 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 0.36 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 4.72 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 3.02 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 0.41 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.06 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 2.61 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 0.44 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.519 HG13 HG22 ' A' ' 56' ' ' VAL . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 2.02 111.23 174.684 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 1.69 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 1.34 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 0.54 111.512 -164.382 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 0.52 110.401 178.243 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.48 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 0.42 111.477 -178.323 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.28 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.36 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 2.6 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.62 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.864 HG12 HD13 ' A' ' 44' ' ' LEU . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 1.66 107.1 178.028 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 0.51 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 1.89 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 0.56 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 0.92 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.15 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 3.12 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.864 HD13 HG12 ' A' ' 37' ' ' VAL . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 0.65 105.531 172.043 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.733 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 0.36 101.934 -179.99 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.734 HG23 HD11 ' A' ' 44' ' ' LEU . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 0.9 106.024 171.382 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.35 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 0.9 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.38 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 2.6 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.13 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 0.41 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 2.77 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 0.47 110.34 174.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.65 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.628 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 0.47 109.312 177.205 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.512 ' HB2' HD21 ' A' ' 67' ' ' LEU . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 0.89 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 0.38 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 0.39 109.925 174.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.48 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 3.99 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 0.5 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 1.92 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 1.45 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 1.59 112.495 173.14 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 6.39 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.33 108.028 170.878 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 3.07 107.865 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.737 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 2.06 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 1.47 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.737 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.37 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 1.98 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.478 HG22 ' HB3' ' A' ' 67' ' ' LEU . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 3.08 110.345 -169.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 2.51 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.13 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 2.19 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.061 ' OD2' ' SG ' ' A' ' 15' ' ' CYS . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.81 114.13 -161.143 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.061 ' SG ' ' OD2' ' A' ' 14' ' ' ASP . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.7 108.381 -172.774 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 0.37 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 0.3 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.57 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 0.32 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 4.37 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.0 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 0.42 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.42 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.86 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 0.42 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.523 HG13 HG22 ' A' ' 56' ' ' VAL . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 2.13 111.388 173.063 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 1.76 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.81 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 0.53 112.075 -173.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 0.54 109.995 -179.23 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.595 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.48 113.372 -177.037 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 0.47 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.28 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 2.86 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 2.26 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.83 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 1.75 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 0.51 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 1.96 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 0.53 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 0.93 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.84 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 2.22 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 0.85 106.043 173.164 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 0.35 103.391 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 0.73 106.586 175.078 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.14 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 0.92 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 3.5 103.208 -163.931 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.18 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.595 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 0.65 113.181 -169.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.11 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 0.56 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.89 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.671 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 0.52 109.551 178.416 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.01 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 0.89 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 0.38 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 0.49 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.56 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 5.48 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 0.73 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.55 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 1.85 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 1.91 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.478 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 2.07 114.421 175.331 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 3.99 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.42 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.49 110.391 175.112 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? . . . . . 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 1.236 ' OD1' ' SG ' ' A' ' 15' ' ' CYS . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 1.236 ' SG ' ' OD1' ' A' ' 14' ' ' ASP . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 109.376 -0.601 . . . . 6.88 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -59.21 -75.66 0.26 Allowed Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.208 0.909 . . . . 2.09 112.717 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.1 m -144.14 157.81 44.09 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.166 -2.161 . . . . 1.75 105.166 164.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.58 115.38 23.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.123 -1.436 . . . . 2.59 107.123 170.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.85 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -105.26 155.25 19.25 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 124.441 1.096 . . . . 1.85 109.691 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.78 156.62 43.28 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.571 0.623 . . . . 1.7 110.876 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.85 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 6.6 m-90 -140.47 152.66 45.81 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 124.503 1.127 . . . . 0.47 111.177 171.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt -99.79 105.07 16.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.422 2.289 . . . . 1.7 110.158 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG11 ' SD ' ' A' ' 13' ' ' MET . 8.7 p -115.83 91.37 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.013 0.925 . . . . 2.21 113.224 -161.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.1 t -78.25 75.44 4.78 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.007 -0.433 . . . . 1.73 110.234 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -179.21 -26.91 0.05 OUTLIER Glycine 0 CA--C 1.534 1.25 0 N-CA-C 115.012 0.765 . . . . 1.41 115.012 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.479 ' SD ' HG21 ' A' ' 22' ' ' VAL . 38.8 mtp -80.18 119.29 22.77 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.086 1.443 . . . . 2.17 111.152 -177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -135.59 -3.24 2.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.808 1.243 . . . . 1.41 113.687 -171.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -138.59 148.7 44.45 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.07 0.948 . . . . 0.68 108.792 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.56 72.75 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.29 -0.256 . . . . 0.33 111.301 175.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -46.15 77.52 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.551 -0.718 . . . . 0.25 110.282 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.554 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.9 m -53.3 -55.8 21.74 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.087 -1.079 . . . . 0.56 108.087 172.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.9 -54.25 10.42 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 119.339 -0.362 . . . . 0.31 111.67 174.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -58.67 -43.61 89.94 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 118.926 0.785 . . . . 5.74 111.398 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -63.72 -36.95 85.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 121.522 -0.736 . . . . 2.87 110.618 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.8 t -64.39 -55.36 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 108.247 -1.02 . . . . 0.54 108.247 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.28 -38.47 83.67 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.298 -0.63 . . . . 2.06 109.298 -174.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -61.35 -50.62 72.19 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.823 -0.548 . . . . 2.7 111.946 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.94 66.42 Favored 'General case' 0 C--N 1.335 -0.03 0 C-N-CA 125.276 1.43 . . . . 0.57 111.727 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.426 ' CG1' HG13 ' A' ' 56' ' ' VAL . 3.7 m -87.58 -45.99 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.865 -0.42 . . . . 1.92 109.865 175.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.8 ttt-85 -56.41 -33.43 65.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.652 -1.28 . . . . 3.71 112.004 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.54 -18.74 31.89 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.922 1.082 . . . . 1.17 113.922 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 49.4 mt -61.26 -74.54 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.329 0.968 . . . . 0.57 112.092 -170.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.31 -71.73 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.779 2.032 . . . . 0.36 110.641 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -47.94 -39.12 17.89 Favored Glycine 0 CA--C 1.529 0.946 0 C-N-CA 125.896 1.712 . . . . 0.32 113.55 -174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.452 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.0 OUTLIER -67.59 123.01 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.299 1.439 . . . . 0.36 111.979 -175.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -99.67 -55.04 2.76 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.776 1.631 . . . . 1.04 109.645 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -116.55 139.45 50.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.383 -0.969 . . . . 1.77 108.383 175.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.3 m -112.17 139.2 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 125.623 1.569 . . . . 2.43 107.672 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -145.53 89.1 1.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 107.393 -1.336 . . . . 1.88 107.393 173.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -102.07 103.37 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 1.84 109.404 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 43.9 tp -99.49 81.62 2.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.578 1.18 . . . . 0.56 108.503 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -55.33 163.97 1.06 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.9 -1.5 . . . . 1.98 110.915 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.29 -46.78 0.65 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.598 1.959 . . . . 0.55 111.59 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 m -77.6 4.38 11.49 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.554 1.142 . . . . 0.92 111.081 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 63.75 30.07 14.72 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 118.513 -0.756 . . . . 4.1 111.679 170.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.62 149.91 38.0 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 115.064 1.505 . . . . 2.05 115.064 176.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -122.45 143.89 49.4 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.792 -1.559 . . . . 0.76 106.792 170.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.662 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -124.91 138.07 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 127.985 2.514 . . . . 0.44 105.168 174.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.539 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.2 t -131.91 135.13 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 C-N-CA 125.249 1.42 . . . . 0.59 107.635 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.22 108.44 19.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 105.396 -2.076 . . . . 1.82 105.396 170.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -131.6 117.63 18.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 124.597 1.159 . . . . 0.83 110.289 -174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -98.55 59.35 1.28 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.809 -1.182 . . . . 2.53 107.809 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -157.77 -89.26 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.236 -1.394 . . . . 2.5 107.236 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 64.9 t0 156.83 94.88 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.06 0 C-N-CA 127.271 2.228 . . . . 3.05 106.232 -163.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -145.92 7.46 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 O-C-N 121.836 -0.54 . . . . 0.45 111.863 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -64.14 -46.44 84.1 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 120.431 1.468 . . . . 7.77 110.067 -171.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' ' CG ' ' A' ' 57' ' ' GLU . . . -57.94 -19.57 31.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.495 1.118 . . . . 0.81 111.792 173.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -81.41 -49.13 11.02 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.155 1.382 . . . . 3.22 111.002 169.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.727 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 79.7 t -55.38 -47.7 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 C-N-CA 124.482 1.113 . . . . 0.34 109.695 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.559 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.79 -51.1 59.73 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.451 -0.944 . . . . 3.67 108.451 -167.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.0 m -45.59 -47.26 14.64 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.646 1.579 . . . . 1.52 112.123 162.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.51 71.04 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.141 0.882 . . . . 0.41 110.723 -176.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.697 HD22 HD13 ' A' ' 67' ' ' LEU . 5.4 mp -61.26 -43.87 98.17 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.282 1.033 . . . . 0.42 110.965 176.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.44 -43.09 93.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 122.799 0.44 . . . . 1.49 110.025 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -62.29 -48.9 77.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.754 0.422 . . . . 2.98 110.693 173.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -36.61 73.18 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.144 0.578 . . . . 0.65 111.222 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.38 44.24 0.25 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.923 1.249 . . . . 0.53 111.913 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -121.66 178.69 4.74 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.313 1.045 . . . . 1.86 110.493 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -140.96 80.85 1.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.003 -1.48 . . . . 2.34 107.003 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.697 HD13 HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -86.93 171.97 10.39 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.251 1.02 . . . . 1.91 110.999 168.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -156.77 148.0 22.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.58 -1.267 . . . . 3.45 107.58 167.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.63 123.09 14.4 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.337 1.455 . . . . 3.23 111.88 -174.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -108.28 58.72 0.61 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.105 0.562 . . . . 2.4 110.622 170.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 63.64 -176.77 0.16 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.652 0.781 . . . . 3.95 110.208 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -104.05 74.86 1.23 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 107.949 -1.13 . . . . 2.02 107.949 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.46 -158.22 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.038 1.335 . . . . 3.4 111.061 -174.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 . . . . . 0 C--O 1.25 1.082 0 N-CA-C 104.314 -2.476 . . . . 8.81 104.314 -178.108 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 109.808 -0.442 . . . . 5.63 109.808 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 126.42 5.5 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 106.021 -2.832 . . . . 1.21 106.021 -157.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 42.3 m -143.52 103.8 4.14 Favored 'General case' 0 CA--C 1.506 -0.716 0 CA-C-N 118.856 1.328 . . . . 1.28 108.231 170.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -91.72 123.74 35.34 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.052 -1.832 . . . . 3.34 106.052 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.806 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 21.4 m-85 -98.96 168.68 9.95 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 124.772 1.229 . . . . 2.05 109.851 169.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 p -140.67 157.03 46.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.293 0.951 . . . . 1.99 112.976 168.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.806 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 10.2 m-90 -133.76 139.49 46.38 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.22 1.808 . . . . 0.27 108.78 169.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -97.28 142.04 29.66 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 105.406 -2.072 . . . . 1.72 105.406 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' H ' ' A' ' 11' ' ' SER . 4.3 p -131.98 -179.39 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 O-C-N 123.54 0.525 . . . . 1.92 110.128 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 10' ' ' VAL . 8.2 t -155.0 92.05 1.41 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 105.533 -2.025 . . . . 2.1 105.533 169.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.85 -8.62 0.24 Allowed Glycine 0 CA--C 1.538 1.498 0 CA-C-O 118.079 -1.401 . . . . 1.96 116.31 -173.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.5 92.01 7.99 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 121.149 2.475 . . . . 3.08 108.389 176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -90.62 -40.4 11.93 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.315 2.246 . . . . 2.08 113.155 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -109.5 143.59 38.93 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.245 1.018 . . . . 1.65 112.378 -174.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.5 -36.11 63.84 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.287 -0.883 . . . . 0.99 110.929 168.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.98 -41.01 95.62 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.62 -0.675 . . . . 0.45 110.838 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.6 m -64.21 -48.66 75.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.625 -1.25 . . . . 1.07 107.625 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.06 -49.04 61.37 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.485 0.714 . . . . 0.6 111.611 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -59.06 -44.51 91.83 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 121.508 -0.745 . . . . 4.23 110.899 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -63.92 -33.48 75.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.336 -0.853 . . . . 2.33 110.582 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.61 -51.22 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 123.672 0.789 . . . . 0.43 109.068 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -58.6 -41.02 84.86 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 119.408 -0.917 . . . . 1.83 108.781 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -68.87 -47.28 66.31 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.757 0.823 . . . . 2.87 111.529 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.65 -38.71 60.86 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.885 1.274 . . . . 0.57 110.402 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.516 HG13 HG22 ' A' ' 56' ' ' VAL . 79.7 t -78.97 -52.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 116.155 -0.475 . . . . 2.27 111.016 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -56.84 -36.89 70.51 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 121.439 -0.788 . . . . 2.27 111.285 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -62.12 -17.19 57.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.933 1.086 . . . . 1.21 113.933 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 92.7 mt -59.87 -72.44 0.11 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.705 1.139 . . . . 0.87 111.836 -171.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.89 -65.74 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 127.215 2.206 . . . . 0.6 109.722 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -39.28 -56.49 2.31 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 125.956 1.741 . . . . 0.57 113.477 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 0.2 OUTLIER -57.98 128.33 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 125.2 1.4 . . . . 0.42 111.802 -169.321 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.92 -53.03 4.32 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.879 -1.526 . . . . 2.19 106.879 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -131.45 140.77 49.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.502 1.121 . . . . 1.62 108.488 -175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -107.97 138.13 35.97 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 C-N-CA 125.059 1.344 . . . . 2.68 108.674 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -146.3 82.94 1.61 Allowed 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 121.732 0.777 . . . . 2.25 109.249 174.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.0 m -86.69 103.11 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 106.986 -1.487 . . . . 1.79 106.986 175.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 20.9 tp -94.07 70.96 3.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 105.179 -2.156 . . . . 1.89 105.179 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -48.38 162.61 0.09 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 110.985 -2.825 . . . . 3.33 110.623 165.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.75 -47.03 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 127.01 2.124 . . . . 1.72 110.373 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.9 p -83.67 2.2 38.75 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.301 0.482 . . . . 2.47 112.301 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 64.63 40.56 5.84 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.92 0.488 . . . . 5.18 111.259 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.65 158.48 43.61 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.641 0.734 . . . . 2.15 111.619 173.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -132.22 143.09 49.69 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 106.644 -1.613 . . . . 0.88 106.644 176.476 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.8 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -127.0 134.08 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 C-N-CA 129.216 3.007 . . . . 0.4 105.288 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.929 HG23 HD11 ' A' ' 44' ' ' LEU . 27.5 t -125.97 131.31 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 107.236 -1.394 . . . . 0.71 107.236 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.58 112.64 24.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.473 -1.677 . . . . 3.43 106.473 172.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.504 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . . . -140.85 128.12 21.03 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.776 0.673 . . . . 0.86 112.086 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.28 58.84 0.6 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.084 1.421 . . . . 2.49 109.387 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.3 -110.34 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 101.963 -3.347 . . . . 3.29 101.963 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.417 ' O ' HG23 ' A' ' 52' ' ' ILE . 5.5 t0 -172.15 136.84 0.87 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 119.977 1.262 . . . . 1.85 111.05 166.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.81 7.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-O 118.14 -0.933 . . . . 0.43 112.181 -174.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 -66.39 -45.89 78.48 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 121.815 2.098 . . . . 2.38 109.878 -165.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.09 -35.08 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.113 -0.949 . . . . 0.5 110.061 172.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.27 -49.01 73.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.355 1.062 . . . . 3.57 110.909 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.644 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.9 t -57.76 -55.66 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 C-N-CA 124.063 0.945 . . . . 0.36 108.772 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HB2' HD11 ' A' ' 67' ' ' LEU . 10.6 pt-20 -65.39 -39.83 92.69 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 119.112 -0.471 . . . . 3.0 111.404 -175.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.1 t -53.04 -46.15 68.35 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.43 0.559 . . . . 1.06 109.925 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.5 72.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.025 -0.422 . . . . 0.35 110.149 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' HD23 ' A' ' 67' ' ' LEU . 7.2 mp -61.34 -44.02 97.89 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.341 1.057 . . . . 0.39 111.012 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -60.79 -44.06 97.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.338 -0.615 . . . . 1.5 109.338 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -65.57 -39.86 92.12 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 111.8 0.296 . . . . 3.03 111.8 174.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.95 73.07 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.606 0.763 . . . . 0.52 110.417 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.33 28.29 1.23 Allowed Glycine 0 CA--C 1.527 0.789 0 C-N-CA 124.709 1.147 . . . . 0.89 112.569 168.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -98.6 179.27 4.74 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.145 0.973 . . . . 1.91 109.632 174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 74.6 m -139.43 63.67 1.49 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 107.527 -1.286 . . . . 1.5 107.527 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.9 pp -78.44 175.78 9.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.244 0.545 . . . . 2.08 111.889 -178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -146.24 142.36 28.29 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.66 -0.867 . . . . 3.33 108.66 164.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -38.33 136.23 0.68 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.498 1.519 . . . . 2.83 112.618 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -125.32 58.92 1.27 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.42 1.488 . . . . 2.0 109.257 164.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 70.04 159.25 0.19 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.003 1.721 . . . . 3.73 113.889 163.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 81.24 8.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.581 -1.19 . . . . 2.01 108.717 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 72.35 -68.24 0.23 Allowed 'General case' 0 C--O 1.231 0.082 0 C-N-CA 124.994 1.317 . . . . 2.87 111.523 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.123 -0.942 . . . . 7.11 108.868 -162.016 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 m . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.843 -0.429 . . . . 6.35 109.843 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 144.44 77.38 0.03 OUTLIER Glycine 0 CA--C 1.529 0.967 0 N-CA-C 109.673 -1.371 . . . . 2.26 109.673 -174.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -109.15 108.32 18.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.596 1.158 . . . . 1.46 108.462 -172.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -95.56 115.79 27.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 121.537 0.684 . . . . 2.79 109.163 -169.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.74 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.8 m-85 -102.77 158.46 16.24 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 125.082 1.353 . . . . 1.97 110.361 172.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.9 t -144.18 150.07 37.45 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.242 1.017 . . . . 1.52 109.491 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.74 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -132.8 140.66 48.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.94 1.296 . . . . 0.38 109.121 172.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -98.28 132.39 43.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 105.298 -2.112 . . . . 1.97 105.298 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.36 -177.92 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.111 0 CA-C-O 121.426 0.631 . . . . 2.52 111.423 -174.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.1 m -146.21 80.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.787 -1.931 . . . . 2.21 105.787 167.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.6 -166.2 31.2 Favored Glycine 0 N--CA 1.432 -1.626 0 N-CA-C 105.693 -2.963 . . . . 3.22 105.693 -161.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm 61.51 86.22 0.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.931 1.692 . . . . 2.22 110.551 -175.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -123.19 -11.21 8.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.608 2.363 . . . . 1.39 113.107 -162.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.6 m -134.51 150.85 50.82 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.466 1.107 . . . . 0.7 109.16 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.917 0.389 . . . . 0.36 110.882 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.61 97.97 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.533 -0.729 . . . . 0.26 110.869 174.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -62.81 -49.04 76.52 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.16 -1.052 . . . . 0.44 108.16 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.06 -57.48 5.75 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 119.281 -0.39 . . . . 0.3 111.141 170.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -57.68 -45.05 86.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.914 0.864 . . . . 3.26 111.078 -174.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -62.48 -38.67 90.78 Favored 'General case' 0 N--CA 1.44 -0.942 0 O-C-N 121.89 -0.506 . . . . 3.87 110.295 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 60' ' ' LEU . 54.7 t -64.42 -52.75 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 118.509 0.595 . . . . 0.45 109.946 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -60.08 -38.56 83.27 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 119.285 0.948 . . . . 2.11 109.844 -175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -60.56 -51.15 70.63 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.896 0.478 . . . . 2.87 111.638 170.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -35.31 68.85 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 124.794 1.238 . . . . 0.45 112.098 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.8 m -84.47 -46.35 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.95 109.729 175.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -54.09 -39.23 66.16 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.559 -0.713 . . . . 1.7 111.587 -174.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -56.74 -18.0 10.99 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.181 1.178 . . . . 0.79 114.181 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 74.8 mt -59.22 -70.89 0.14 Allowed 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.795 1.179 . . . . 0.44 112.013 -171.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.0 -66.67 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 127.032 2.133 . . . . 0.4 109.737 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.63 -49.59 11.78 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.651 1.596 . . . . 0.45 113.601 -173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.07 122.38 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 C-N-CA 125.55 1.54 . . . . 0.3 111.47 -170.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -97.12 -55.41 2.86 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.564 1.145 . . . . 0.91 108.361 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -121.77 146.78 46.71 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 106.913 -1.514 . . . . 2.56 106.913 170.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 p -128.66 147.69 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 107.326 -1.361 . . . . 2.07 107.326 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -150.88 94.32 2.06 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.072 -1.455 . . . . 1.92 107.072 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.9 m -99.48 108.75 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.613 -0.514 . . . . 1.77 109.613 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.8 tp -99.07 78.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 107.714 -1.217 . . . . 0.6 107.714 -172.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -57.63 160.73 4.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.041 -1.436 . . . . 1.98 110.1 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.55 -40.72 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.553 1.541 . . . . 0.72 112.947 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 m -79.33 -4.51 51.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.581 0.752 . . . . 0.95 110.472 166.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 71.22 32.92 2.1 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 123.864 0.866 . . . . 4.12 112.282 165.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.95 154.54 37.32 Favored 'General case' 0 C--N 1.343 0.322 0 O-C-N 121.411 -0.806 . . . . 2.77 113.126 176.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -120.95 149.14 43.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.503 -1.295 . . . . 0.75 107.503 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.742 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -134.35 138.35 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 C-N-CA 127.442 2.297 . . . . 0.42 106.233 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.594 HG23 ' CD1' ' A' ' 44' ' ' LEU . 2.4 t -138.09 133.11 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 125.634 1.574 . . . . 0.61 107.397 -174.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -109.13 107.15 17.34 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.003 -1.851 . . . . 2.14 106.003 174.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -136.55 125.3 23.93 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.967 0.907 . . . . 0.85 109.058 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -118.69 57.07 0.87 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 123.065 1.412 . . . . 2.64 108.145 -167.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.64 -108.87 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 101.235 -3.617 . . . . 3.52 101.235 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -172.33 136.31 0.8 Allowed 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 120.551 1.523 . . . . 2.44 112.016 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.6 pp -156.88 6.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 CA-C-O 117.936 -1.031 . . . . 0.37 112.471 -177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -62.48 -46.97 86.06 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 122.138 2.245 . . . . 2.62 109.825 -168.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.97 -33.64 57.55 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 114.546 -1.206 . . . . 0.4 110.991 173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -68.64 -46.53 68.96 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.78 -0.575 . . . . 2.89 111.566 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.615 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.3 t -56.2 -50.02 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.153 0.581 . . . . 0.33 109.616 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.582 ' HA ' HD21 ' A' ' 67' ' ' LEU . 7.6 pt-20 -70.55 -46.44 63.56 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.691 -0.855 . . . . 3.42 108.691 -169.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -45.5 -49.23 13.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.773 0.429 . . . . 1.96 111.845 164.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.72 -50.7 68.11 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 122.88 0.472 . . . . 0.31 110.345 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -59.45 -47.93 83.59 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.065 0.946 . . . . 0.47 110.737 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.44 -46.78 83.2 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.15 -0.685 . . . . 4.31 109.15 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.9 tttm -66.16 -37.85 86.66 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.737 1.215 . . . . 4.42 111.966 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.58 89.33 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.09 0.956 . . . . 0.51 110.522 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.49 35.2 0.58 Allowed Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.545 1.069 . . . . 0.5 112.851 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.19 -176.49 3.1 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.026 1.33 . . . . 1.94 107.616 167.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.3 t -149.94 76.79 1.3 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 106.799 -1.556 . . . . 1.86 106.799 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.1 pp -83.9 170.3 14.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.56 -1.2 . . . . 2.1 111.401 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -136.88 151.66 49.34 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.742 -1.117 . . . . 3.49 108.913 166.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -46.63 141.82 3.57 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.566 1.546 . . . . 4.39 110.892 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -139.91 51.48 1.71 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.848 -0.797 . . . . 2.52 108.848 173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 53.71 -169.33 0.06 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.781 -0.645 . . . . 3.99 112.203 170.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.64 63.71 1.04 Allowed 'General case' 0 C--N 1.34 0.175 0 O-C-N 120.627 -1.296 . . . . 1.9 110.138 -170.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.76 68.79 0.68 Allowed 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.569 1.147 . . . . 2.54 108.417 -169.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 C--O 1.25 1.083 0 O-C-N 125.124 1.515 . . . . 6.44 107.606 -162.007 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 107.123 -1.436 . . . . 5.74 107.123 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.21 133.31 2.88 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.126 1.346 . . . . 1.36 109.924 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 m -140.24 146.61 38.85 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 105.515 -2.032 . . . . 1.35 105.515 159.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.32 122.23 46.89 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.452 -1.314 . . . . 2.4 107.452 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.794 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 11.7 m-85 -109.17 150.03 28.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 117.865 -1.064 . . . . 2.11 110.459 168.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.8 m -131.47 149.78 52.4 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.958 0.903 . . . . 1.8 111.194 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.794 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.7 m-90 -132.33 141.74 49.06 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.182 1.393 . . . . 0.31 108.8 169.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 137.56 36.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 105.642 -1.984 . . . . 2.22 105.642 172.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 12' ' ' GLY . 2.7 m -119.56 -177.24 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 O-C-N 123.971 0.795 . . . . 2.45 111.135 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -144.24 41.69 1.38 Allowed 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 108.494 -0.928 . . . . 2.23 108.494 168.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 10' ' ' VAL . . . -147.28 -145.04 4.11 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 105.306 -3.118 . . . . 3.05 105.306 175.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 18.1 mtm 58.37 84.15 0.11 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.123 1.369 . . . . 2.26 111.884 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -124.34 -6.7 7.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.824 2.049 . . . . 1.29 113.246 -168.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -139.22 154.11 47.96 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 124.131 0.972 . . . . 0.69 109.725 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.36 -36.94 81.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.047 0.451 . . . . 0.36 110.759 173.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.45 -44.9 95.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 121.877 -0.514 . . . . 0.28 110.121 174.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.5 m -60.71 -49.59 76.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.191 0.997 . . . . 0.47 108.729 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.76 -57.72 5.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.348 0.522 . . . . 0.39 111.218 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -53.13 -45.1 68.2 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.556 0.616 . . . . 5.16 110.894 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -63.93 -38.23 90.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 119.267 -0.397 . . . . 2.62 110.702 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.1 t -65.4 -51.09 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.275 -0.639 . . . . 0.55 109.275 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.99 -36.53 83.86 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 119.145 -1.022 . . . . 1.83 109.941 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -64.52 -47.38 79.08 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.926 0.784 . . . . 2.66 111.703 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.03 67.5 Favored 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 125.083 1.353 . . . . 0.62 111.051 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG23 ' CD1' ' A' ' 60' ' ' LEU . 5.2 t -83.64 -50.97 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 122.896 0.478 . . . . 2.11 111.286 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.13 -32.66 70.05 Favored 'General case' 0 C--N 1.333 -0.122 0 O-C-N 121.428 -0.795 . . . . 1.91 111.649 -171.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -56.98 -17.36 9.43 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.135 1.161 . . . . 1.07 114.135 174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.2 mt -62.88 -72.1 0.14 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.926 1.239 . . . . 0.6 110.938 -171.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.38 -61.99 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 127.396 2.278 . . . . 0.49 109.143 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.79 -47.3 53.46 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.523 1.059 . . . . 0.55 113.046 -171.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.412 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -59.52 123.31 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.683 1.193 . . . . 0.39 112.045 -172.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -98.01 -56.32 2.53 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.075 1.35 . . . . 0.99 108.85 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -115.54 143.13 45.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 108.736 -0.838 . . . . 1.73 108.736 174.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.4 m -109.43 142.68 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 126.094 1.758 . . . . 2.66 107.721 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -148.3 80.35 1.46 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.458 -0.942 . . . . 1.63 108.458 171.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.8 m -96.36 103.63 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 107.902 -1.148 . . . . 1.76 107.902 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -100.65 88.58 3.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 107.676 -1.231 . . . . 0.55 107.676 -175.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -66.14 170.47 5.69 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.66 -1.154 . . . . 1.81 110.583 173.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.03 -60.92 0.44 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.713 1.605 . . . . 0.61 109.503 -171.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.0 m -80.81 47.39 0.97 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.815 0.846 . . . . 1.2 110.058 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 11.08 46.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 131.335 3.854 . . . . 3.53 118.814 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.03 147.64 40.66 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 119.868 1.213 . . . . 3.13 111.766 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.782 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -121.36 143.5 49.17 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 104.894 -2.262 . . . . 0.8 104.894 172.164 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.746 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -132.35 141.66 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.093 2.157 . . . . 0.39 105.313 172.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.782 HG23 HD11 ' A' ' 44' ' ' LEU . 45.5 t -133.0 142.07 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 107.633 -1.247 . . . . 0.7 107.633 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -109.94 106.76 16.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 106.493 -1.669 . . . . 2.66 106.493 171.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.616 ' HB3' ' HE2' ' A' ' 6' ' ' TYR . . . -133.25 123.83 26.25 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.865 0.866 . . . . 0.79 110.494 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -106.03 57.32 0.66 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.949 1.299 . . . . 2.41 108.431 -172.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.13 -106.6 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 104.539 -2.393 . . . . 3.56 104.539 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.29 107.29 0.09 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.75 1.159 . . . . 3.03 110.504 -174.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.426 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.78 7.48 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 CA-C-O 118.54 -0.743 . . . . 0.46 112.722 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -68.32 -43.07 78.39 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.457 1.935 . . . . 2.88 108.886 -169.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -61.11 -28.96 69.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.658 -1.155 . . . . 0.46 111.176 172.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -68.45 -47.13 67.97 Favored 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.23 -0.919 . . . . 2.86 110.857 170.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.738 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.1 t -56.67 -53.22 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.233 1.013 . . . . 0.38 109.249 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.557 ' HB2' HD11 ' A' ' 67' ' ' LEU . 24.1 pt-20 -60.48 -46.1 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 110.233 -0.284 . . . . 2.41 110.233 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.6 t -53.45 -45.14 69.4 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 110.325 -0.25 . . . . 1.01 110.325 170.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.5 -49.06 67.81 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.284 0.634 . . . . 0.42 110.702 -171.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.554 ' CD2' HD23 ' A' ' 67' ' ' LEU . 4.4 mp -62.55 -44.62 95.89 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.126 0.97 . . . . 0.46 110.269 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -58.09 -42.99 86.81 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.058 -0.349 . . . . 1.44 110.058 177.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mttt -62.58 -45.77 91.4 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.178 0.591 . . . . 2.9 111.596 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.63 -31.8 71.91 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.405 0.682 . . . . 0.72 111.365 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.96 35.09 0.85 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.953 1.263 . . . . 0.51 112.603 169.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -103.44 173.03 6.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.315 1.046 . . . . 2.05 109.239 172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.8 m -133.56 60.55 1.7 Allowed 'General case' 0 C--N 1.334 -0.098 0 N-CA-C 108.564 -0.902 . . . . 1.64 108.564 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' ' 57' ' ' GLU . 1.1 pp -82.24 173.67 11.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 113.02 0.748 . . . . 2.02 113.02 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -141.48 143.28 33.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.9 -1.148 . . . . 3.54 107.9 169.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -40.92 131.63 2.45 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.879 1.271 . . . . 2.61 111.169 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.49 58.37 1.39 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.753 0.787 . . . . 2.7 109.622 164.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 61.28 -171.55 0.15 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.868 -1.06 . . . . 3.8 110.75 162.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -128.26 73.43 1.48 Allowed 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 121.349 -0.844 . . . . 1.93 109.675 -171.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.55 -56.84 0.51 Allowed 'General case' 0 C--O 1.231 0.108 0 C-N-CA 126.029 1.732 . . . . 2.98 110.884 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 116.97 -1.491 . . . . 8.28 107.704 158.864 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 CA--C 1.524 -0.042 0 N-CA-C 107.911 -1.144 . . . . 5.26 107.911 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.68 160.02 37.9 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 109.588 -1.405 . . . . 1.71 109.588 167.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -142.88 123.25 13.88 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 107.097 -1.446 . . . . 1.31 107.097 168.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.29 125.86 41.09 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.961 1.838 . . . . 3.36 107.624 175.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.674 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 5.5 m-85 -98.35 177.44 5.36 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 113.27 -1.786 . . . . 2.42 110.963 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -154.67 151.89 29.31 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 118.631 0.65 . . . . 1.49 111.342 172.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.674 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 23.3 m-90 -137.12 141.48 42.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 126.115 1.766 . . . . 0.45 109.284 172.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -98.67 126.28 44.23 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.404 -1.702 . . . . 2.76 106.404 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 m -98.96 -178.37 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 125.056 1.342 . . . . 2.63 107.711 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.2 t -153.42 67.19 0.77 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.038 -1.468 . . . . 1.72 107.038 173.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.55 -38.81 0.14 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-O 119.912 -0.382 . . . . 1.41 112.857 -171.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttm -68.94 112.55 5.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 117.849 0.824 . . . . 2.11 111.817 -170.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 p-10 -134.23 -12.2 2.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.127 1.371 . . . . 1.19 114.63 -156.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -134.73 160.93 36.62 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.477 1.035 . . . . 0.71 109.671 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.3 -32.62 71.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.354 -0.384 . . . . 0.4 111.27 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.64 71.83 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.306 -0.871 . . . . 0.25 109.676 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.6 m -53.04 -53.3 52.21 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.82 1.248 . . . . 0.49 108.27 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.19 -56.77 6.05 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 119.006 -0.521 . . . . 0.34 112.202 172.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 28.5 mtt180 -56.2 -39.52 72.57 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.391 0.996 . . . . 3.77 111.749 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -62.78 -46.63 87.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.524 -0.735 . . . . 3.14 110.407 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.478 HG13 HD11 ' A' ' 60' ' ' LEU . 88.9 t -61.51 -56.33 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.345 -0.613 . . . . 0.4 109.345 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -36.54 79.62 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.902 -0.571 . . . . 2.67 110.467 -174.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -64.09 -53.12 54.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.891 0.768 . . . . 3.11 110.745 172.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.37 -36.03 52.76 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.354 1.062 . . . . 0.45 111.364 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.7 t -73.54 -57.16 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.465 0.706 . . . . 2.16 110.871 171.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -58.54 -34.18 70.73 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.215 1.006 . . . . 2.04 111.751 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.86 -15.83 34.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.457 0.91 . . . . 0.7 113.457 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 75.2 mt -61.7 -75.82 0.06 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.677 1.126 . . . . 0.41 111.748 -173.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.03 -71.13 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.388 1.875 . . . . 0.38 110.594 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.84 -47.26 6.14 Favored Glycine 0 C--N 1.342 0.887 0 C-N-CA 125.866 1.698 . . . . 0.32 113.321 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -67.61 125.39 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 C-N-CA 123.836 0.854 . . . . 0.37 112.061 -169.46 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -98.53 -55.52 2.72 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.259 1.023 . . . . 0.99 108.555 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -122.48 111.98 17.49 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 106.531 -1.655 . . . . 2.11 106.531 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.14 138.08 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.21 -1.033 . . . . 2.21 108.21 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -143.81 91.06 2.19 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.926 0.394 . . . . 1.87 110.107 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.838 HG12 HD13 ' A' ' 44' ' ' LEU . 15.3 m -89.66 123.84 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.58 -1.637 . . . . 1.55 106.58 171.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.89 86.95 2.57 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.81 -1.552 . . . . 0.76 106.81 172.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -58.29 162.2 3.77 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 113.898 -1.501 . . . . 1.85 110.096 172.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.0 -31.12 0.2 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.553 1.541 . . . . 0.9 114.137 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 m -99.07 20.48 13.3 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.655 1.182 . . . . 0.98 109.19 168.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 29.99 59.51 0.19 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 127.721 2.408 . . . . 4.47 114.777 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.47 159.88 43.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 118.85 -1.14 . . . . 3.45 112.481 164.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD13 HG12 ' A' ' 37' ' ' VAL . 1.1 tp -139.19 148.49 43.21 Favored 'General case' 0 N--CA 1.425 -1.702 0 N-CA-C 104.312 -2.477 . . . . 0.71 104.312 172.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.633 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -137.96 131.8 42.6 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.284 0 C-N-CA 130.355 3.462 . . . . 0.31 103.189 -176.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 52' ' ' ILE . 75.8 t -125.95 124.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 107.398 -1.334 . . . . 0.71 107.398 176.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.32 112.5 24.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.677 -1.971 . . . . 2.48 105.677 174.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.443 ' HB3' ' CE2' ' A' ' 6' ' ' TYR . . . -141.01 138.41 33.68 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.762 0.664 . . . . 0.72 111.023 -172.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.23 57.57 0.7 Allowed 'General case' 0 C--N 1.331 -0.203 0 O-C-N 124.695 1.247 . . . . 2.37 107.83 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -159.39 -86.58 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 104.487 -2.412 . . . . 2.53 104.487 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.7 t0 160.54 132.07 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.765 3.226 . . . . 2.35 106.49 173.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.558 HD11 HG11 ' A' ' 46' ' ' VAL . 2.0 pp -154.46 12.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.615 0 C-N-CA 124.656 1.182 . . . . 0.5 111.382 -175.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -66.41 -45.2 80.74 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 119.967 -1.708 . . . . 2.41 109.771 -164.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.0 -28.72 69.24 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.072 -0.967 . . . . 0.49 110.775 173.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.79 -45.74 70.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.446 -0.784 . . . . 3.68 111.153 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.658 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 54.1 t -57.62 -54.75 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 123.847 0.859 . . . . 0.39 109.116 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -44.51 96.5 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.057 -0.497 . . . . 3.04 111.024 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.6 t -54.28 -43.29 70.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.442 0.565 . . . . 1.06 110.083 170.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.75 -48.39 69.26 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 123.036 0.534 . . . . 0.38 110.51 -173.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 HD23 ' A' ' 67' ' ' LEU . 6.4 mp -60.19 -43.37 95.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.717 0.807 . . . . 0.43 110.423 174.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -61.23 -42.42 98.58 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 122.288 -0.258 . . . . 1.49 110.62 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -63.45 -46.35 86.69 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.282 0.633 . . . . 2.91 111.315 174.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.08 83.72 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.72 0.808 . . . . 0.57 110.936 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.86 48.78 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.978 1.275 . . . . 0.54 112.347 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -128.09 155.47 44.35 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.606 1.162 . . . . 1.99 109.894 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.1 m -118.26 70.89 0.82 Allowed 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.834 0.853 . . . . 1.61 109.291 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -85.16 -178.93 6.91 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 114.132 1.16 . . . . 2.08 114.132 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -152.83 142.12 21.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.209 -1.404 . . . . 4.26 107.209 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -43.02 133.33 3.78 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 126.492 1.917 . . . . 2.81 111.486 170.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -118.18 55.71 0.88 Allowed 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.14 -1.059 . . . . 2.41 108.14 162.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 57.24 -174.69 0.07 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.512 1.149 . . . . 3.84 111.445 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -119.09 112.94 20.17 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.191 -2.152 . . . . 2.03 105.191 170.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.94 -175.29 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.021 -1.103 . . . . 4.52 108.021 163.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.305 -0.855 . . . . 11.31 109.314 176.642 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.846 0.355 . . . . 4.78 110.421 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 57.61 -130.41 50.96 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.453 -1.059 . . . . 1.52 110.453 -174.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.469 HG21 ' CE1' ' A' ' 6' ' ' TYR . 10.8 m -143.49 166.26 25.28 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 106.244 -1.761 . . . . 1.73 106.244 163.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -118.91 126.16 51.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.268 -1.753 . . . . 2.68 106.268 163.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.757 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 19.4 m-85 -115.99 150.07 37.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 117.71 -1.138 . . . . 1.91 109.535 168.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.6 m -132.79 153.36 51.33 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.165 0.986 . . . . 1.69 111.66 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.4 m-90 -135.47 142.42 45.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.883 1.673 . . . . 0.37 110.888 173.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.94 129.76 54.02 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 106.25 -1.759 . . . . 4.06 106.25 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.82 -177.24 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.682 0.674 . . . . 1.93 110.478 -174.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -152.82 91.47 1.55 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.937 -1.505 . . . . 2.43 106.937 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.82 2.67 0.2 Allowed Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.34 1.296 . . . . 1.75 116.34 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.4 mtm -100.7 102.96 14.19 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 120.736 2.268 . . . . 2.08 109.086 176.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -122.37 -5.79 8.79 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.723 1.209 . . . . 1.51 113.82 -172.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.9 m -137.09 148.05 46.48 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 123.812 0.845 . . . . 0.62 109.348 -168.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.67 84.34 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.486 0.315 . . . . 0.35 111.121 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.15 -50.29 72.47 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.169 -0.332 . . . . 0.25 110.329 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.3 m -51.43 -52.17 48.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.597 -0.89 . . . . 0.45 108.597 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.91 -53.37 33.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.609 0.364 . . . . 0.24 111.339 177.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -61.62 -35.93 79.3 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 118.871 0.76 . . . . 4.12 111.647 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mttt -61.18 -43.85 98.23 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.0 -1.063 . . . . 2.42 109.985 172.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.2 t -68.28 -50.56 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 122.888 0.475 . . . . 0.47 110.634 -175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -51.32 -45.44 62.24 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 107.851 -1.166 . . . . 2.36 107.851 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -70.33 -49.63 47.41 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 120.996 0.427 . . . . 2.6 110.6 -171.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.44 -28.82 60.62 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.49 1.516 . . . . 0.44 111.561 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CG2' HG13 ' A' ' 56' ' ' VAL . 25.1 t -84.04 -49.01 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 122.386 0.275 . . . . 2.08 111.112 170.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.79 -38.04 64.11 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.342 -0.849 . . . . 1.81 111.499 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -55.64 -17.92 6.74 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.077 . . . . 1.09 113.909 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 88.1 mt -63.01 -74.49 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.461 1.028 . . . . 0.5 111.45 -173.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.95 -66.84 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.121 2.168 . . . . 0.39 110.382 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.0 -47.08 4.16 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 126.206 1.86 . . . . 0.35 112.996 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.16 123.48 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 C-N-CA 125.103 1.361 . . . . 0.35 112.286 -173.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -96.13 -61.0 1.51 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.714 -1.217 . . . . 1.15 107.714 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.61 132.98 53.72 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.503 -1.295 . . . . 1.81 107.503 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.6 m -103.52 130.28 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 C-N-CA 125.468 1.507 . . . . 2.5 107.226 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -128.85 93.16 3.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.67 -1.233 . . . . 2.63 107.67 168.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 10.0 p -91.82 120.68 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 N-CA-C 107.025 -1.472 . . . . 2.92 107.025 170.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.8 tp -119.63 80.79 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.681 -1.229 . . . . 0.57 107.681 175.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -58.95 164.39 2.94 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.107 -1.406 . . . . 1.94 110.13 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.1 -48.42 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.884 2.074 . . . . 0.59 111.866 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m -73.66 -13.94 61.08 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.045 0.538 . . . . 0.97 110.092 164.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 73.83 32.89 1.06 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.982 0.913 . . . . 5.02 111.872 163.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 156.71 45.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 122.291 1.043 . . . . 2.79 111.689 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 45' ' ' VAL 0.301 1.2 tp -134.89 144.75 47.69 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 104.448 -2.427 . . . . 0.86 104.448 -176.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.512 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -134.55 137.07 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 130.161 3.384 . . . . 0.3 104.61 -177.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.434 HG11 HD11 ' A' ' 52' ' ' ILE . 59.0 t -133.27 129.85 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 N-CA-C 107.246 -1.39 . . . . 0.72 107.246 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.43 96.37 6.46 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 104.399 -2.445 . . . . 2.4 104.399 176.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -116.92 131.7 56.89 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 124.56 1.144 . . . . 0.67 110.061 -174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.38 57.62 0.63 Allowed 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.98 -1.119 . . . . 2.34 107.98 -178.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -164.69 -107.43 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 103.039 -2.949 . . . . 2.43 103.039 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -177.95 113.75 0.08 Allowed 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.383 1.873 . . . . 2.16 106.075 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.434 HD11 HG11 ' A' ' 46' ' ' VAL . 2.4 pp -138.07 4.11 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 C-N-CA 123.557 0.743 . . . . 0.38 111.729 -177.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -45.61 85.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 120.817 -1.177 . . . . 2.34 109.818 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.89 -18.46 64.8 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.217 -0.902 . . . . 0.69 111.548 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -45.47 38.21 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.354 -0.841 . . . . 2.78 111.965 161.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.725 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 86.0 t -53.72 -54.86 16.59 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 119.537 1.062 . . . . 0.43 109.932 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.685 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -59.51 -52.97 63.28 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.433 -0.803 . . . . 3.1 109.544 -172.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 t -50.32 -46.13 55.26 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.963 0.905 . . . . 0.92 110.669 170.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.96 79.16 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 121.503 -0.748 . . . . 0.37 110.374 -172.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.3 mp -64.08 -41.67 97.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.22 1.008 . . . . 0.54 110.365 176.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -59.25 -42.84 92.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 122.194 -0.316 . . . . 1.46 110.751 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.34 -49.03 77.21 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.051 0.54 . . . . 2.86 110.18 173.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.14 76.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.621 0.768 . . . . 0.47 111.151 -178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.06 43.89 0.26 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.679 1.133 . . . . 0.46 111.94 169.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -119.5 168.53 10.89 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.372 1.069 . . . . 1.86 109.864 175.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -121.78 66.68 0.9 Allowed 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 124.485 1.114 . . . . 1.39 108.743 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.685 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -81.14 166.82 20.32 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 112.6 0.592 . . . . 1.68 112.6 176.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -155.18 148.11 24.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.623 -0.51 . . . . 5.09 109.623 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -45.16 126.55 6.23 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 126.097 1.759 . . . . 2.8 111.655 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -118.02 55.55 0.88 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 122.97 0.508 . . . . 2.34 110.217 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.8 143.36 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.565 1.546 . . . . 5.43 112.556 176.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.22 72.66 4.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.764 -1.107 . . . . 2.03 108.931 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 83.27 -158.93 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 2.92 111.372 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.208 -2.515 . . . . 7.91 104.208 176.943 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 105.017 -2.216 . . . . 6.68 105.017 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.4 152.5 21.96 Favored Glycine 0 N--CA 1.444 -0.81 0 N-CA-C 103.974 -3.65 . . . . 1.78 103.974 159.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 38.3 m -135.17 110.65 9.12 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 119.237 1.519 . . . . 1.13 108.003 169.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.48 120.76 33.28 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.172 -2.159 . . . . 2.87 105.172 174.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.836 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.4 m-85 -105.28 162.01 13.79 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 124.092 0.957 . . . . 1.99 108.867 170.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -141.48 150.26 41.99 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.657 0.783 . . . . 1.54 111.253 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.836 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 7.8 m-90 -133.81 146.97 51.16 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.092 1.357 . . . . 0.41 108.938 173.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -105.32 125.4 50.94 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 105.899 -1.889 . . . . 1.61 105.899 176.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.436 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.5 p -131.28 95.76 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.455 0.702 . . . . 2.11 112.542 -163.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.67 70.9 4.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.291 0.567 . . . . 2.05 110.785 -172.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -172.8 -46.63 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.975 -0.453 . . . . 1.46 113.538 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.512 ' SD ' HG21 ' A' ' 22' ' ' VAL . 36.3 mtp -60.29 122.45 14.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.758 0.779 . . . . 2.14 112.299 -170.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -138.72 -19.12 1.05 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.166 1.786 . . . . 1.22 113.802 -157.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -132.08 151.36 51.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.985 1.314 . . . . 0.63 108.93 -174.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.67 78.43 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 122.519 0.328 . . . . 0.39 111.049 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.53 -50.02 71.19 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.539 0.609 . . . . 0.37 110.471 177.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.0 m -52.35 -52.76 51.54 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.713 1.205 . . . . 0.5 108.517 175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.95 -55.2 18.4 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.11 0.964 . . . . 0.37 110.591 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -55.61 -44.64 77.23 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.88 -0.513 . . . . 3.39 110.328 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mttt -63.67 -37.5 87.59 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 119.164 -0.446 . . . . 2.43 110.531 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' CYS . 62.4 t -61.87 -53.99 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.684 -0.858 . . . . 0.42 108.684 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -63.52 -37.34 86.93 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 118.718 -1.193 . . . . 1.97 110.611 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -61.66 -49.22 77.41 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.49 0.716 . . . . 2.9 111.02 174.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.44 -37.02 67.17 Favored 'General case' 0 CA--C 1.526 0.02 0 C-N-CA 124.754 1.222 . . . . 0.44 110.887 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.595 HG13 HG22 ' A' ' 56' ' ' VAL . 62.9 t -79.42 -52.25 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.291 0.567 . . . . 2.24 111.434 176.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -61.01 -32.08 71.68 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.961 0.905 . . . . 2.05 111.081 -168.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -62.14 -16.36 52.16 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.588 0.959 . . . . 0.86 113.588 176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 80.5 mt -62.94 -77.98 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.572 1.078 . . . . 0.59 111.548 -172.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.68 -69.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.324 1.85 . . . . 0.44 111.175 -177.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -41.66 -45.72 4.6 Favored Glycine 0 C--N 1.342 0.902 0 C-N-CA 126.207 1.861 . . . . 0.42 113.556 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -66.74 127.28 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.112 1.365 . . . . 0.36 111.319 -175.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -95.69 -56.27 2.74 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.389 -1.337 . . . . 1.31 107.389 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -129.02 126.98 40.67 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.128 -1.805 . . . . 2.07 106.128 -174.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.4 p -112.14 145.23 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 108.381 -0.97 . . . . 2.11 108.381 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -141.89 97.35 3.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.993 1.317 . . . . 2.49 108.089 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.529 HG12 HD13 ' A' ' 44' ' ' LEU . 20.3 m -101.31 101.07 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.395 1.078 . . . . 1.56 109.302 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.38 83.98 3.13 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.452 -1.314 . . . . 0.59 107.452 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -59.15 166.74 2.0 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 113.862 -1.517 . . . . 1.84 110.307 171.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -55.59 0.63 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.104 1.761 . . . . 0.63 110.265 -174.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.6 m -68.55 -5.95 22.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.322 1.449 . . . . 1.03 112.8 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 68.79 36.49 2.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.951 0.9 . . . . 3.64 111.555 172.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.8 138.02 21.67 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 120.321 1.419 . . . . 2.26 111.995 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.884 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -120.81 141.75 50.24 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 105.123 -2.177 . . . . 0.55 105.123 172.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.706 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -129.22 135.52 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 C-N-CA 129.304 3.042 . . . . 0.43 106.499 173.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.884 HG23 HD11 ' A' ' 44' ' ' LEU . 28.6 t -130.07 122.55 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 124.446 1.098 . . . . 0.73 108.457 178.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -101.37 108.03 19.54 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.315 -1.735 . . . . 2.21 106.315 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -125.74 155.87 40.31 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.805 1.642 . . . . 1.31 109.615 -172.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -123.1 59.48 1.07 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.807 0.813 . . . . 2.56 109.011 168.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -157.69 -89.16 0.03 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 107.257 -1.386 . . . . 2.64 107.257 166.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 t0 158.43 99.45 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 129.668 3.187 . . . . 1.87 104.622 -174.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.502 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -131.65 -3.03 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-O 118.063 -0.97 . . . . 0.41 111.298 175.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -51.13 -39.35 56.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.611 1.55 . . . . 3.57 111.775 -176.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.25 -32.01 73.17 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.461 0.648 . . . . 0.49 111.079 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -64.99 -50.11 67.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.478 -0.764 . . . . 3.1 111.248 166.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 78.5 t -55.61 -51.92 53.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.794 0.837 . . . . 0.37 109.623 -177.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.742 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -63.36 -41.91 98.86 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-O 119.648 -0.215 . . . . 2.43 110.482 -175.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.7 t -55.22 -44.34 75.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 122.093 -0.379 . . . . 0.92 110.204 168.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.78 65.72 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.271 0.628 . . . . 0.31 110.472 -173.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 HG13 ' A' ' 22' ' ' VAL . 6.3 mp -58.02 -45.66 86.54 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.24 1.016 . . . . 0.45 110.212 174.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.37 -42.81 96.57 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 122.261 -0.274 . . . . 1.49 110.71 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -64.52 -45.83 85.55 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.27 0.628 . . . . 3.01 111.677 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -36.61 76.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.29 0.636 . . . . 0.48 110.788 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.66 45.56 0.26 Allowed Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.818 1.199 . . . . 0.44 111.952 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 22' ' ' VAL . 76.6 m-85 -122.08 157.24 31.85 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.128 0.971 . . . . 1.89 110.942 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.3 p -112.58 70.36 0.71 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.959 1.704 . . . . 2.91 108.563 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.742 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.34 169.67 16.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.609 0.966 . . . . 1.86 113.609 174.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -149.3 139.61 22.31 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.827 -1.546 . . . . 3.29 106.827 173.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -52.41 127.6 22.91 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.091 1.356 . . . . 2.57 110.888 175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -117.94 57.36 0.83 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.803 0.841 . . . . 2.36 110.2 171.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 69.04 148.29 0.06 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 125.85 1.66 . . . . 3.74 112.385 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.38 77.37 7.37 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.956 -1.02 . . . . 2.38 109.841 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 70.44 -176.88 0.2 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.758 0.823 . . . . 2.8 111.517 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.021 1.328 . . . . 7.95 109.787 178.886 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.539 0.537 0 CA-C-O 119.144 -0.455 . . . . 6.52 110.793 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.23 136.95 8.79 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.427 -1.069 . . . . 2.11 110.427 -174.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.66 126.75 40.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.714 -1.588 . . . . 1.45 106.714 178.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -96.51 137.6 35.35 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.457 -1.312 . . . . 2.39 107.457 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.704 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -126.56 174.51 8.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.388 1.475 . . . . 1.94 110.182 -176.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.2 t -157.49 153.63 27.37 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 119.904 1.229 . . . . 1.71 112.567 170.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.704 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 20.4 m-90 -140.07 144.97 37.11 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.229 1.812 . . . . 0.44 109.198 172.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -99.1 125.3 44.6 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 125.553 1.541 . . . . 1.79 107.115 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.14 101.43 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.183 0.993 . . . . 2.12 113.266 -170.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.75 74.24 4.31 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.373 -0.603 . . . . 2.0 109.373 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -176.39 -33.67 0.05 OUTLIER Glycine 0 CA--C 1.533 1.197 0 N-CA-C 114.732 0.653 . . . . 1.36 114.732 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 mtm -70.89 105.46 3.27 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.487 1.643 . . . . 2.22 111.475 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.62 -12.78 10.28 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 115.346 1.61 . . . . 1.55 115.346 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.2 m -136.43 156.34 48.75 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-N 119.831 1.196 . . . . 0.61 109.493 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.34 84.6 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 122.552 0.341 . . . . 0.35 111.194 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.5 -52.18 65.59 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.65 -0.656 . . . . 0.33 109.702 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.535 ' O ' HG23 ' A' ' 22' ' ' VAL . 68.0 m -48.81 -57.63 6.07 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.561 1.144 . . . . 0.49 109.046 172.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.2 -52.33 16.07 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.929 0.892 . . . . 0.26 111.115 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -58.45 -42.16 86.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.729 -0.607 . . . . 3.85 110.467 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -63.82 -40.8 97.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.149 -0.969 . . . . 2.37 109.795 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 18' ' ' CYS . 32.7 t -62.51 -49.16 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 122.952 0.501 . . . . 0.55 109.838 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -63.25 -42.5 99.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.75 -1.204 . . . . 1.85 107.75 -173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -65.87 -40.56 91.75 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.365 0.666 . . . . 2.82 109.923 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.65 -43.77 72.65 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.383 1.073 . . . . 0.48 111.613 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.771 HG22 HG11 ' A' ' 32' ' ' VAL . 7.2 p -78.21 -48.45 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 117.709 0.231 . . . . 2.57 110.679 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -57.11 -36.93 71.22 Favored 'General case' 0 CA--C 1.527 0.082 0 O-C-N 121.876 -0.515 . . . . 1.94 111.329 -168.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.59 -18.14 50.95 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.051 1.13 . . . . 0.92 114.051 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.03 -73.78 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.711 1.141 . . . . 1.16 111.629 -170.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 166.56 -65.38 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 126.006 1.723 . . . . 0.59 110.188 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.453 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -54.2 -42.42 72.78 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 124.31 0.957 . . . . 0.48 113.269 -170.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.771 HG11 HG22 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -64.32 125.13 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 124.764 1.225 . . . . 0.35 110.841 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -98.24 -54.59 3.02 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 108.766 -0.827 . . . . 0.95 108.766 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -123.46 137.35 54.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 105.287 -2.116 . . . . 1.99 105.287 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.73 144.06 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.328 -1.36 . . . . 2.13 107.328 178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -144.78 89.68 2.0 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.679 -0.86 . . . . 1.62 108.679 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.749 HG12 HD13 ' A' ' 44' ' ' LEU . 1.1 m -92.74 113.97 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 106.412 -1.699 . . . . 1.64 106.412 173.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 45.0 tp -106.59 86.22 2.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 107.068 -1.456 . . . . 0.55 107.068 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -59.59 166.26 2.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.241 -1.345 . . . . 1.94 110.778 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.65 -51.69 0.69 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.994 1.717 . . . . 0.52 110.468 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 m -69.86 2.04 3.81 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.965 1.306 . . . . 0.97 112.592 170.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 62.01 29.75 17.78 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.048 0.939 . . . . 3.61 112.081 171.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 158.95 43.47 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 120.496 1.498 . . . . 2.87 113.952 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -135.97 145.95 46.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.429 -2.063 . . . . 0.65 105.429 175.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.781 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.24 128.67 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 C-N-CA 130.694 3.597 . . . . 0.37 103.065 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.595 HG23 HD11 ' A' ' 44' ' ' LEU . 69.0 t -115.92 143.04 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.292 -1.373 . . . . 0.85 107.292 171.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -111.54 106.63 15.54 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.135 -2.172 . . . . 2.12 105.135 170.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.51 145.56 51.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.894 -1.521 . . . . 0.92 106.894 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -114.5 56.51 0.72 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.937 0.875 . . . . 3.21 109.067 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 167.18 -143.18 0.0 OUTLIER 'General case' 0 C--O 1.238 0.481 0 N-CA-C 104.312 -2.477 . . . . 3.26 104.312 -170.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -139.09 106.85 5.63 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 118.869 0.759 . . . . 3.02 110.639 -156.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -149.16 3.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 117.755 -1.117 . . . . 0.62 113.932 -177.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -60.58 -49.01 79.27 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 121.59 1.995 . . . . 2.78 109.798 -168.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.443 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -53.61 -37.1 62.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.388 1.075 . . . . 0.44 111.011 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.95 -50.28 72.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.386 0.675 . . . . 3.24 111.364 170.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 26' ' ' VAL . 42.1 t -56.47 -51.22 67.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.582 -0.895 . . . . 0.67 108.582 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.1 pt-20 -66.22 -43.63 86.11 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.17 -0.468 . . . . 2.75 110.645 -172.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.7 t -50.4 -48.84 55.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.581 -0.526 . . . . 1.09 109.581 167.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.68 -50.54 70.75 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 121.525 -0.734 . . . . 0.33 110.664 -172.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 67' ' ' LEU . 5.1 mp -59.65 -43.33 93.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.796 0.839 . . . . 0.49 110.633 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.23 -40.5 96.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.977 -0.452 . . . . 1.49 110.743 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -62.83 -47.38 83.66 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.065 -0.346 . . . . 2.69 110.065 173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.85 75.45 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.074 0.549 . . . . 0.45 111.215 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.44 44.21 0.32 Allowed Glycine 0 CA--C 1.528 0.844 0 C-N-CA 125.126 1.346 . . . . 0.43 111.959 170.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -121.35 162.21 20.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.503 1.121 . . . . 2.0 111.212 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.8 p -121.61 59.87 0.96 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.257 1.823 . . . . 2.62 110.151 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 60' ' ' LEU 0.325 0.2 OUTLIER -80.82 170.73 15.91 Favored 'General case' 0 CA--C 1.528 0.096 0 N-CA-C 113.563 0.949 . . . . 1.72 113.563 179.934 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -149.88 140.91 22.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.073 -1.454 . . . . 3.27 107.073 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -54.5 133.79 46.07 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.077 1.351 . . . . 2.72 111.528 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -120.54 61.3 0.88 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.635 1.174 . . . . 2.29 109.822 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 64.3 -177.87 0.17 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.981 0.912 . . . . 5.06 111.936 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.76 62.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 107.613 -1.255 . . . . 1.87 107.613 -175.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 76.87 -51.4 0.57 Allowed 'General case' 0 C--O 1.231 0.115 0 C-N-CA 126.038 1.735 . . . . 3.34 111.153 -166.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 65.6 mt-10 . . . . . 0 C--O 1.258 1.518 0 C-N-CA 127.603 2.361 . . . . 6.45 105.918 166.936 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 107.375 -1.343 . . . . 4.72 107.375 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.62 -178.89 44.08 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.657 -1.377 . . . . 1.12 109.657 169.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.89 119.04 13.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.267 -1.383 . . . . 1.41 107.267 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.67 128.44 42.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.607 -1.257 . . . . 3.3 107.607 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.594 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 20.5 m-85 -131.95 141.34 49.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 117.679 -1.153 . . . . 2.19 108.717 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.19 157.67 23.34 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 119.023 0.828 . . . . 1.48 112.563 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.742 ' CE3' HG11 ' A' ' 56' ' ' VAL . 23.5 m-90 -132.98 141.6 48.4 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.572 -1.27 . . . . 0.47 107.572 164.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -99.51 138.05 37.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.508 -1.664 . . . . 2.8 106.508 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -123.17 176.15 5.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.283 0.563 . . . . 2.66 111.092 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.6 m -153.51 75.47 1.05 Allowed 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.243 -1.392 . . . . 2.07 107.243 172.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.84 -37.08 0.12 Allowed Glycine 0 CA--C 1.533 1.16 0 CA-C-O 120.153 -0.248 . . . . 1.43 113.466 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 mtm -70.06 125.75 27.69 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.326 1.063 . . . . 2.01 111.3 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -145.01 -2.09 0.82 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.649 0.981 . . . . 1.59 113.649 -174.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.2 m -139.86 153.32 47.0 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.895 0.878 . . . . 0.74 108.96 -168.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.8 -33.56 75.05 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 122.889 0.475 . . . . 0.44 111.268 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.62 65.31 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.61 -0.682 . . . . 0.26 109.587 175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -49.58 -56.46 9.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.214 1.006 . . . . 0.56 108.666 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.4 -52.61 16.3 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.885 0.474 . . . . 0.3 111.325 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 -62.19 -38.46 89.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 119.718 -0.793 . . . . 3.62 111.296 -177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.06 -40.78 97.04 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 120.013 -0.675 . . . . 2.58 109.964 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.735 HG13 HD11 ' A' ' 60' ' ' LEU . 91.8 t -66.8 -46.72 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.846 0.859 . . . . 0.4 110.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -62.06 -41.69 98.41 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.884 -1.154 . . . . 1.86 107.884 -176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -65.44 -43.95 88.84 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 111.873 0.323 . . . . 2.37 111.873 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.04 -40.56 61.27 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.46 1.104 . . . . 0.76 110.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 56' ' ' VAL . 9.8 m -85.69 -43.89 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 121.249 -0.18 . . . . 1.86 111.201 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.1 ttt-85 -58.07 -33.39 69.01 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 120.665 -1.272 . . . . 3.97 111.353 -171.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.88 -16.75 31.59 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.024 1.12 . . . . 0.95 114.024 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 55' ' ' GLN . 64.5 mt -60.65 -78.82 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.333 0.97 . . . . 0.64 112.103 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 167.18 -74.68 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.19 1.796 . . . . 0.52 110.955 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.45 -39.8 10.49 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 126.175 1.845 . . . . 0.38 114.266 -175.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.438 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -69.67 122.9 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 124.922 1.289 . . . . 0.46 110.909 -173.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -100.05 -63.2 1.15 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.091 0.956 . . . . 1.17 109.216 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -113.26 106.71 14.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 106.746 -1.576 . . . . 2.27 106.746 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.42 146.72 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 108.672 -0.862 . . . . 2.14 108.672 173.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -146.46 97.01 2.86 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.734 0.814 . . . . 2.43 109.13 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.662 HG12 HD13 ' A' ' 44' ' ' LEU . 1.9 m -96.01 111.72 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 107.706 -1.22 . . . . 1.68 107.706 175.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.1 tp -99.58 82.95 2.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.62 -1.252 . . . . 0.53 107.62 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -58.59 167.37 1.49 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.369 -1.287 . . . . 2.18 110.674 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.78 -60.13 0.51 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 124.727 1.211 . . . . 0.54 110.47 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -79.89 47.53 0.88 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.007 0.923 . . . . 1.15 109.555 173.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 12.39 46.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 131.397 3.879 . . . . 4.57 118.973 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.52 161.51 42.57 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 120.811 1.641 . . . . 2.7 113.327 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.762 HD12 ' N ' ' A' ' 45' ' ' VAL 0.252 0.1 OUTLIER -136.31 149.38 48.39 Favored 'General case' 0 N--CA 1.421 -1.892 0 N-CA-C 105.07 -2.196 . . . . 0.59 105.07 177.688 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.762 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -134.43 137.4 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 C-N-CA 131.155 3.782 . . . . 0.29 104.551 -179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -124.35 133.42 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.204 -2.147 . . . . 0.99 105.204 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.31 106.76 16.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 103.706 -2.702 . . . . 2.21 103.706 168.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -126.37 142.17 51.63 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.304 1.042 . . . . 1.03 108.381 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.06 55.24 1.13 Allowed 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 106.936 -1.505 . . . . 2.62 106.936 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -162.13 -98.25 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 103.608 -2.738 . . . . 2.42 103.608 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 t0 172.89 129.08 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.534 2.334 . . . . 2.3 106.395 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.605 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -154.61 13.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 C-N-CA 124.73 1.212 . . . . 0.48 111.699 -176.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -50.2 68.39 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.681 -1.262 . . . . 2.8 109.366 -167.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -25.02 60.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.524 -1.216 . . . . 0.43 111.015 175.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB3' HD13 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -76.37 -47.2 24.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.416 1.486 . . . . 3.08 110.592 174.366 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.742 HG11 ' CE3' ' A' ' 8' ' ' TRP . 30.7 t -51.77 -56.94 4.22 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 C-N-CA 125.36 1.464 . . . . 0.44 109.394 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 67' ' ' LEU . 9.3 pt-20 -61.41 -42.99 99.61 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.559 -0.746 . . . . 2.94 110.509 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -49.42 63.03 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.199 -0.297 . . . . 0.84 110.199 168.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.16 73.21 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.046 0.45 . . . . 0.47 110.376 -172.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.735 HD11 HG13 ' A' ' 22' ' ' VAL . 4.8 mp -59.48 -42.21 91.58 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.437 0.695 . . . . 0.49 111.207 175.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -62.3 -39.59 93.5 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 122.135 -0.353 . . . . 1.61 110.768 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -64.55 -46.3 83.41 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.931 -0.396 . . . . 3.61 109.931 172.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.01 74.48 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.924 0.49 . . . . 0.58 111.479 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 121.15 39.33 0.59 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.295 1.426 . . . . 0.47 112.725 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -114.83 145.87 41.68 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.18 0.992 . . . . 2.1 109.637 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.2 t -109.16 67.05 0.64 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.693 -1.225 . . . . 2.12 107.693 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.591 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -81.17 -178.42 6.9 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.15 -0.477 . . . . 2.02 111.457 -178.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -144.99 142.48 29.84 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.845 -0.798 . . . . 3.44 108.845 171.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.413 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 8.8 p-10 -59.31 120.4 9.21 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.405 1.882 . . . . 4.12 111.358 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -134.14 62.14 1.66 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.317 1.056 . . . . 4.02 109.032 164.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -58.5 155.52 12.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.021 -1.072 . . . . 7.57 109.197 160.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -160.5 -59.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.073 -1.421 . . . . 5.07 108.345 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 62.74 -178.86 0.14 Allowed 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 124.013 0.82 . . . . 2.96 110.479 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.189 1.796 . . . . 9.25 112.596 -172.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.382 0.512 . . . . 4.3 112.382 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -129.5 -146.8 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.729 -1.349 . . . . 1.16 109.729 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -119.8 158.7 26.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 106.472 -1.677 . . . . 1.26 106.472 170.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.23 129.49 50.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.901 -1.518 . . . . 2.37 106.901 171.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 14.1 m-85 -122.38 148.59 44.89 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.181 1.392 . . . . 1.9 107.903 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.0 t -127.9 158.15 38.58 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 123.676 0.79 . . . . 1.89 109.554 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.6 m-90 -135.27 143.79 46.46 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.187 -1.412 . . . . 0.37 107.187 164.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -98.73 140.69 32.55 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 105.701 -1.963 . . . . 2.62 105.701 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -132.07 173.48 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 123.339 0.656 . . . . 1.82 109.602 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 t -138.17 95.07 2.95 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 105.247 -2.131 . . . . 2.02 105.247 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 166.34 -54.25 0.25 Allowed Glycine 0 CA--C 1.529 0.964 0 CA-C-O 119.961 -0.355 . . . . 1.36 112.512 -175.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mtm -60.24 113.44 2.37 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.017 0.747 . . . . 2.12 113.017 -172.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -137.13 -15.79 1.47 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.865 1.666 . . . . 1.25 114.215 -160.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.0 m -135.57 157.64 46.37 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.658 1.183 . . . . 0.71 109.487 -173.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -32.05 71.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.554 0.341 . . . . 0.41 111.342 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.93 -52.02 61.71 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.294 -0.879 . . . . 0.28 109.562 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.2 m -49.99 -53.49 26.19 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.821 1.248 . . . . 0.45 108.695 172.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.83 -57.03 6.15 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.126 0.571 . . . . 0.34 111.668 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -58.02 -41.18 82.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 119.126 0.875 . . . . 3.44 111.399 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -64.25 -41.43 96.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 121.539 -0.726 . . . . 3.21 110.63 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 18' ' ' CYS . 88.7 t -65.49 -53.21 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.906 -0.776 . . . . 0.43 108.906 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -58.0 -41.2 82.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.77 -0.456 . . . . 2.12 109.77 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -63.1 -51.2 67.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.988 -0.445 . . . . 2.9 111.022 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.67 -32.73 63.5 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 125.053 1.341 . . . . 0.41 111.695 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.457 ' CG1' HG13 ' A' ' 56' ' ' VAL . 13.1 m -83.52 -45.27 18.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 117.93 0.332 . . . . 1.87 111.242 170.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -53.78 -36.17 62.11 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.204 -0.935 . . . . 1.83 111.704 -175.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -57.27 -19.0 19.08 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.897 1.073 . . . . 1.27 113.897 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 76.1 mt -62.06 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.515 1.052 . . . . 0.46 112.606 -169.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.92 -74.26 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.45 1.9 . . . . 0.49 111.011 -176.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.31 -41.46 11.83 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.056 1.789 . . . . 0.37 113.763 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 p -64.54 122.77 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 126.191 1.797 . . . . 0.45 111.549 -174.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -104.77 -63.35 1.23 Allowed 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.897 1.279 . . . . 1.08 109.203 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 tp60 -111.26 107.54 16.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 107.161 -1.422 . . . . 2.32 107.161 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.9 p -84.72 147.55 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.299 -1.0 . . . . 1.98 108.299 173.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -151.31 97.26 2.4 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 107.946 -1.131 . . . . 2.26 107.946 175.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.6 m -99.63 110.57 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.317 -0.623 . . . . 1.68 109.317 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.7 tp -97.6 88.54 4.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.567 -1.642 . . . . 0.52 106.567 177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -64.82 171.53 3.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.115 -1.402 . . . . 2.01 110.045 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.1 -64.94 0.34 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 125.028 1.331 . . . . 0.7 109.247 -176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -79.01 48.8 0.87 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.42 1.088 . . . . 1.3 109.393 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 4.24 50.74 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.696 1 C-N-CA 132.516 4.326 . . . . 4.47 119.309 177.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.36 113.03 6.0 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.926 1.239 . . . . 2.63 108.03 -169.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -97.73 146.6 25.2 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 105.734 -1.95 . . . . 0.81 105.734 175.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.6 t -131.61 138.43 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 128.075 2.55 . . . . 0.59 105.324 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.492 HG11 HD11 ' A' ' 52' ' ' ILE . 1.8 t -129.39 129.93 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 106.05 -1.833 . . . . 0.81 106.05 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -106.4 110.17 22.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 103.876 -2.638 . . . . 1.92 103.876 165.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.74 139.74 52.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.648 -1.241 . . . . 0.72 107.648 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.45 54.91 1.03 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.529 -1.656 . . . . 2.74 106.529 -176.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -157.46 -89.8 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 104.633 -2.358 . . . . 2.48 104.633 169.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 t0 165.66 124.08 0.01 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 128.743 2.817 . . . . 2.43 105.266 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.492 HD11 HG11 ' A' ' 46' ' ' VAL . 2.5 pp -154.56 20.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 124.857 1.263 . . . . 0.42 110.773 -178.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -70.14 -49.68 48.21 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 120.578 -1.326 . . . . 2.65 108.052 -169.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.35 -41.8 63.35 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.974 -1.012 . . . . 0.61 110.352 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -59.09 -50.51 73.77 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.358 -0.839 . . . . 3.41 112.103 171.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.775 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.9 t -55.34 -55.3 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.409 0.683 . . . . 0.35 109.29 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.439 ' HB2' HD21 ' A' ' 67' ' ' LEU . 10.8 pt-20 -61.61 -42.86 99.48 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.915 -0.402 . . . . 2.81 109.915 -176.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -56.08 -38.38 70.61 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.224 -0.297 . . . . 1.13 111.358 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.53 -53.18 17.17 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 123.245 0.618 . . . . 0.4 109.869 -176.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.622 HD22 HD13 ' A' ' 67' ' ' LEU . 5.7 mp -57.22 -44.05 83.4 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.984 0.914 . . . . 0.52 110.643 176.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.68 -41.11 98.92 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 122.128 -0.358 . . . . 1.53 110.356 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -48.69 80.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.07 0.395 . . . . 2.86 110.821 171.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.95 -36.8 82.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.541 0.736 . . . . 0.6 111.298 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 122.59 39.65 0.53 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.845 1.212 . . . . 0.6 112.184 171.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -112.08 159.08 18.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.391 1.076 . . . . 1.97 109.457 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.4 m -118.51 72.44 0.87 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.607 1.163 . . . . 1.43 108.24 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.622 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -82.04 169.17 17.03 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.876 0.695 . . . . 1.59 112.876 175.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -136.88 134.87 37.31 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.072 -1.085 . . . . 3.33 108.072 170.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 66.3 t0 -52.64 117.25 2.76 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 126.394 1.878 . . . . 3.19 111.782 176.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -129.49 60.96 1.56 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.044 0.926 . . . . 3.86 109.34 161.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -54.67 170.62 0.16 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.296 1.046 . . . . 7.54 111.503 158.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 49.6 40.19 18.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 113.825 -1.534 . . . . 4.2 111.473 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 133.3 54.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 123.245 0.618 . . . . 5.4 109.707 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 . . . . . 0 C--O 1.249 1.066 0 N-CA-C 106.935 -1.506 . . . . 7.63 106.935 165.386 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.3 m . . . . . 0 C--O 1.227 -0.081 0 N-CA-C 110.149 -0.315 . . . . 5.68 110.149 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.11 173.84 38.35 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.285 -1.126 . . . . 1.33 110.285 170.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.8 m -143.02 113.45 7.35 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 121.47 -1.018 . . . . 1.11 108.583 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 115.95 28.44 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 106.854 -1.536 . . . . 2.68 106.854 177.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.756 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 41.8 m-85 -99.45 162.59 12.94 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.209 -1.36 . . . . 2.09 108.737 168.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.7 t -139.72 158.34 44.27 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.457 0.703 . . . . 1.59 110.878 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.9 m-90 -139.08 147.06 41.51 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 125.124 1.37 . . . . 0.44 110.245 172.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -99.15 117.31 33.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.841 -1.911 . . . . 2.41 105.841 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.2 p -119.25 95.37 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 119.361 0.982 . . . . 2.06 112.802 -165.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -80.1 81.21 6.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.837 -0.801 . . . . 1.75 108.837 -177.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.07 -45.44 0.12 Allowed Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.536 -0.302 . . . . 1.43 112.752 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.2 mtp -61.85 120.58 11.01 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.229 0.612 . . . . 2.54 112.559 -170.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -137.51 -17.17 1.32 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.339 1.856 . . . . 1.25 113.723 -158.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -132.89 153.37 51.43 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.576 1.15 . . . . 0.6 109.499 -175.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.66 -32.52 74.12 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.4 -0.364 . . . . 0.34 111.018 174.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.56 -47.56 78.3 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.485 -0.759 . . . . 0.27 110.182 176.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -54.05 -53.66 50.05 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.496 1.118 . . . . 0.45 108.121 174.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.75 -56.17 7.96 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 122.628 0.371 . . . . 0.25 111.945 173.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -59.51 -40.16 86.2 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.707 0.685 . . . . 3.54 111.647 -176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -64.93 -40.78 95.57 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.308 -0.87 . . . . 2.57 110.105 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 HD11 ' A' ' 60' ' ' LEU . 85.3 t -66.08 -52.72 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 118.437 0.562 . . . . 0.55 109.862 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -57.54 -42.18 82.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 109.494 -0.558 . . . . 2.26 109.494 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.68 -53.23 59.9 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.797 0.439 . . . . 2.76 110.773 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -35.27 67.75 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.776 1.231 . . . . 0.55 112.0 -176.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.465 ' CG1' HG13 ' A' ' 56' ' ' VAL . 12.6 m -79.44 -46.1 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 120.516 -0.474 . . . . 1.8 110.333 171.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -53.99 -37.86 64.44 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.58 -0.7 . . . . 1.73 111.778 -174.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -58.58 -18.33 29.01 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.102 1.149 . . . . 0.81 114.102 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.2 mt -59.51 -73.11 0.09 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.752 1.16 . . . . 0.4 111.966 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.13 -66.47 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.268 2.227 . . . . 0.39 110.569 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.41 -45.37 6.67 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 126.095 1.807 . . . . 0.35 113.552 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -68.88 122.1 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 126.192 1.797 . . . . 0.35 111.467 -172.489 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -99.65 -60.46 1.53 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.967 1.307 . . . . 1.09 108.943 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -114.92 107.54 15.54 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.342 -1.355 . . . . 1.99 107.342 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.24 140.56 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.937 -0.764 . . . . 2.07 108.937 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -142.49 91.83 2.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.278 -1.008 . . . . 2.61 108.278 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 44' ' ' LEU . 1.8 m -95.5 114.95 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.526 -0.916 . . . . 1.69 108.526 174.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -106.69 86.19 2.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.438 1.114 . . . . 0.51 108.177 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -61.25 167.64 3.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 114.186 -1.37 . . . . 1.81 110.675 172.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.18 -56.24 0.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.963 1.705 . . . . 0.57 110.184 -175.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.1 m -70.11 1.37 4.76 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.603 1.561 . . . . 0.98 112.626 173.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 65.16 32.34 10.22 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.847 0.859 . . . . 4.12 111.863 167.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.63 143.97 24.09 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 120.635 1.561 . . . . 2.31 112.574 178.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -127.92 137.65 52.37 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 107.01 -1.478 . . . . 0.72 107.01 179.002 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.653 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.7 t -122.18 142.98 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 128.804 2.842 . . . . 0.41 106.842 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.566 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -140.22 116.84 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 N-CA-C 105.769 -1.937 . . . . 0.82 105.769 -173.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.87 108.05 20.64 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 105.477 -2.045 . . . . 2.73 105.477 176.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.24 122.08 28.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 124.373 1.046 . . . . 0.73 109.953 -170.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.37 55.39 0.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.031 -1.47 . . . . 2.52 107.031 -175.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -160.93 -100.33 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.725 -2.324 . . . . 2.45 104.725 171.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 53.0 t0 178.37 106.1 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.268 2.227 . . . . 2.35 106.362 174.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.7 pp -135.0 -9.43 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.95 0 CA-C-O 117.321 -1.323 . . . . 0.49 112.985 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.79 -47.6 2.11 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 121.655 2.025 . . . . 3.07 113.237 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.51 -27.96 69.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.161 0.505 . . . . 0.57 111.636 179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.78 -48.77 57.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.495 0.718 . . . . 3.38 111.48 164.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.678 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 76.4 t -53.96 -52.57 34.96 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.366 0 CA-C-N 118.977 0.808 . . . . 0.37 109.27 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HB2' HD21 ' A' ' 67' ' ' LEU . 8.9 pt-20 -63.93 -49.45 72.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.654 -0.499 . . . . 3.24 109.654 -171.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 20.8 t -49.32 -47.76 46.88 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.208 0.603 . . . . 0.87 110.486 167.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.3 -47.02 71.82 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 123.96 0.904 . . . . 0.48 111.207 -170.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.658 HD22 HD13 ' A' ' 67' ' ' LEU . 4.9 mp -61.05 -45.98 92.54 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.268 1.027 . . . . 0.48 109.404 175.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.38 -49.29 76.66 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.213 -0.662 . . . . 4.16 109.213 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.56 -45.63 84.93 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.902 0.881 . . . . 2.76 111.767 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.17 -29.14 70.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.956 0.903 . . . . 0.55 111.203 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.55 48.37 0.47 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.701 1.143 . . . . 0.54 111.401 170.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -123.37 176.22 6.27 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.2 1.0 . . . . 1.87 109.527 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -136.84 85.24 2.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.312 -1.366 . . . . 2.2 107.312 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.658 HD13 HD22 ' A' ' 60' ' ' LEU 0.312 0.2 OUTLIER -84.32 164.72 18.81 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.671 -0.695 . . . . 1.77 111.239 168.417 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -130.57 134.81 47.31 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.213 -1.032 . . . . 5.59 108.213 173.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -45.12 114.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 129.197 2.999 . . . . 5.04 112.235 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -132.42 56.97 1.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 123.006 1.384 . . . . 2.45 107.859 172.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.96 155.08 37.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.061 -1.024 . . . . 8.39 108.625 168.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.24 94.34 0.06 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.639 1.575 . . . . 4.25 111.883 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.1 -46.69 5.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 114.92 1.452 . . . . 4.55 114.92 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.258 1.5 0 N-CA-C 103.156 -2.905 . . . . 7.74 103.156 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 112.414 0.524 . . . . 4.04 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 160.06 -164.47 34.32 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 107.047 -2.421 . . . . 1.36 107.047 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -122.74 129.83 52.21 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 106.097 -1.816 . . . . 1.5 106.097 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -97.47 127.41 43.4 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 106.887 -1.523 . . . . 2.85 106.887 169.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.756 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 53.1 m-85 -120.23 158.12 27.68 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.618 1.167 . . . . 2.38 108.562 171.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.1 t -141.39 153.9 45.32 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.604 0.762 . . . . 1.58 110.484 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.756 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 7.1 m-90 -137.32 139.46 40.87 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 125.863 1.665 . . . . 0.38 108.834 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -96.21 130.17 43.34 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.901 -1.889 . . . . 1.67 105.901 172.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HE3' ' A' ' 13' ' ' MET . 7.2 p -129.96 91.1 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.157 0 C-N-CA 124.111 0.965 . . . . 2.09 112.917 -166.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.0 81.68 6.22 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 109.143 -0.688 . . . . 2.1 109.143 -174.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 178.02 -35.98 0.08 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-N 116.478 -0.328 . . . . 1.56 113.239 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.554 ' HE3' HG21 ' A' ' 10' ' ' VAL . 5.9 mtt -65.33 125.57 25.5 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.941 0.871 . . . . 2.6 112.936 -175.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -134.67 -11.44 2.36 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.397 1.258 . . . . 1.41 114.397 -170.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -135.79 146.62 47.77 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 119.325 0.966 . . . . 0.82 109.782 -165.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -38.97 87.06 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.705 0.288 . . . . 0.55 110.627 173.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.1 -50.18 74.73 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.0 -0.437 . . . . 0.38 110.384 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.464 ' O ' HG23 ' A' ' 22' ' ' VAL . 86.9 m -50.67 -55.56 15.9 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.76 1.224 . . . . 0.72 108.655 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -48.83 -51.66 28.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.904 0.482 . . . . 0.32 111.643 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -64.12 -45.98 86.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.649 0.737 . . . . 3.88 110.578 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.71 -40.45 92.35 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.593 -0.521 . . . . 3.09 109.593 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HE2' ' A' ' 13' ' ' MET . 72.9 t -61.47 -55.89 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.566 -0.902 . . . . 0.4 108.566 175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -59.56 -39.86 85.41 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 119.808 -0.757 . . . . 2.36 109.818 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.09 -53.51 57.54 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.521 0.729 . . . . 3.08 111.59 170.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.07 -30.62 64.44 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 125.026 1.33 . . . . 0.54 112.293 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.0 m -87.82 -43.39 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 109.855 -0.424 . . . . 1.95 109.855 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -53.51 -37.83 63.14 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.17 -0.956 . . . . 2.25 112.049 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -58.06 -18.68 26.19 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.929 1.085 . . . . 0.85 113.929 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 75.4 mt -58.72 -74.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.418 1.008 . . . . 0.44 112.571 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.06 -72.44 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.964 2.106 . . . . 0.38 111.308 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.06 -39.87 3.1 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.724 2.107 . . . . 0.44 113.968 -177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.446 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.26 124.92 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 C-N-CA 125.978 1.711 . . . . 0.43 111.371 -173.121 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -97.91 -55.05 2.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.496 1.118 . . . . 0.93 108.478 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -119.88 138.85 53.16 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 108.443 -0.947 . . . . 1.7 108.443 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.44 141.2 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 125.481 1.512 . . . . 2.34 107.848 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -145.5 83.44 1.66 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.885 -0.783 . . . . 1.87 108.885 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.579 HG22 HD13 ' A' ' 44' ' ' LEU . 97.4 t -92.95 100.16 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 125.782 1.633 . . . . 2.33 108.177 176.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.3 tp -98.81 84.81 3.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 107.338 -1.356 . . . . 0.69 107.338 175.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 8.6 p90 -58.08 164.67 2.21 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.029 -1.441 . . . . 2.03 110.502 172.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.94 -53.33 0.69 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.358 1.463 . . . . 0.54 110.835 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 m -67.7 -2.84 7.62 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.855 1.262 . . . . 1.09 112.337 169.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 69.59 29.88 4.14 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.321 1.049 . . . . 3.49 111.939 167.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 139.43 22.22 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 120.461 1.482 . . . . 2.35 112.67 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.4 OUTLIER -122.03 135.63 54.85 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 106.229 -1.767 . . . . 0.78 106.229 174.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.72 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -123.46 132.65 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 129.319 3.048 . . . . 0.3 104.867 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.67 HG23 HD11 ' A' ' 44' ' ' LEU . 1.1 t -123.34 126.92 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 106.403 -1.703 . . . . 0.88 106.403 -179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -106.94 105.76 15.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 105.152 -2.166 . . . . 2.45 105.152 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -127.9 137.51 52.33 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.519 1.127 . . . . 0.7 108.265 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -112.93 57.61 0.66 Allowed 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 122.514 1.15 . . . . 3.64 108.86 175.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -158.91 -104.03 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 104.289 -2.485 . . . . 2.5 104.289 168.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -177.02 106.29 0.06 Allowed 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 126.748 2.019 . . . . 1.78 105.974 175.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.402 ' C ' HD12 ' A' ' 52' ' ' ILE . 2.8 pp -136.61 -6.9 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.793 0 CA-C-O 118.114 -0.946 . . . . 0.48 112.675 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -42.48 -43.89 3.84 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 121.039 1.745 . . . . 2.92 112.856 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.14 -23.71 63.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.187 0.595 . . . . 0.57 111.687 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.05 -46.08 58.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.239 -0.913 . . . . 3.15 111.374 162.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.668 ' CB ' ' HZ3' ' A' ' 8' ' ' TRP . 68.8 t -57.41 -54.81 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 C-N-CA 123.698 0.799 . . . . 0.32 109.343 -176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.05 -54.78 43.11 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 123.006 0.523 . . . . 3.01 110.073 -174.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.3 t -46.11 -46.76 17.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.414 1.486 . . . . 0.92 111.124 168.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.11 68.24 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.221 -0.924 . . . . 0.32 110.757 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.456 HD11 HG13 ' A' ' 22' ' ' VAL . 6.7 mp -60.13 -43.88 95.32 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.915 1.286 . . . . 0.56 110.635 176.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -60.2 -45.92 91.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.868 -0.419 . . . . 1.46 109.868 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -63.08 -42.17 99.58 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.692 0.397 . . . . 3.28 112.019 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.19 88.87 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.174 0.59 . . . . 0.46 110.922 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.85 46.36 0.24 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.81 1.195 . . . . 0.52 112.169 171.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -120.83 166.59 13.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.343 1.057 . . . . 1.86 110.233 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.0 m -123.15 74.61 1.24 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.112 1.365 . . . . 1.54 108.662 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 57' ' ' GLU 0.314 0.2 OUTLIER -83.66 165.28 19.1 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 113.246 0.832 . . . . 1.72 113.246 172.826 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -151.18 138.36 19.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.356 -0.979 . . . . 3.96 108.356 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.38 119.53 3.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.189 2.596 . . . . 4.23 112.993 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -111.2 60.54 0.61 Allowed 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.882 1.273 . . . . 2.23 110.578 170.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 59.48 -171.93 0.12 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.0 0.37 . . . . 4.84 112.0 169.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -124.23 56.13 1.27 Allowed 'General case' 0 C--N 1.34 0.174 0 O-C-N 121.171 -0.956 . . . . 1.83 109.626 -173.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 63.46 69.29 0.57 Allowed 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.419 1.088 . . . . 2.67 109.141 -169.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 . . . . . 0 C--O 1.258 1.501 0 CA-C-O 116.843 -1.551 . . . . 6.48 108.22 -158.67 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 106.452 -1.685 . . . . 6.23 106.452 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.9 164.1 11.32 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 107.264 -2.334 . . . . 2.25 107.264 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.6 m -132.57 122.22 24.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.465 -1.309 . . . . 1.4 107.465 174.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -98.09 109.55 22.29 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 106.934 -1.506 . . . . 2.62 106.934 176.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.868 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 61.9 m-85 -106.12 167.98 9.44 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 123.408 0.683 . . . . 2.2 110.231 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -148.82 146.78 28.15 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.047 1.339 . . . . 1.42 110.645 -175.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.868 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.3 m-90 -135.85 142.41 44.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.35 1.46 . . . . 0.29 108.908 174.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -98.81 125.3 44.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.987 -1.486 . . . . 1.65 106.987 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.87 102.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 C-N-CA 124.091 0.956 . . . . 2.04 112.685 -174.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.9 t -77.09 65.42 2.72 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.846 -0.427 . . . . 1.8 109.846 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.71 -49.82 0.02 OUTLIER Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.657 -0.524 . . . . 1.34 113.035 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 29.3 mtm -63.45 121.73 14.54 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.332 1.066 . . . . 2.07 112.416 -172.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 p-10 -139.19 -10.89 1.26 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.682 1.993 . . . . 1.23 113.413 -162.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 m -136.41 151.91 50.03 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.746 1.218 . . . . 0.58 108.61 -173.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.57 -29.71 70.35 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.679 -0.237 . . . . 0.37 111.075 175.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.37 67.83 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.638 -0.663 . . . . 0.38 110.432 176.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -53.23 -53.07 56.06 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.505 1.122 . . . . 0.51 108.17 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.29 -53.0 31.68 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.714 -0.66 . . . . 0.36 111.34 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -38.96 93.24 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.763 1.165 . . . . 3.54 111.652 -174.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.3 mttm -62.51 -41.67 99.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.654 -0.654 . . . . 2.45 109.973 175.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 60' ' ' LEU . 41.3 t -67.27 -55.78 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 109.649 -0.5 . . . . 0.7 109.649 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -52.72 -42.12 64.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.767 -0.457 . . . . 2.06 109.767 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -62.0 -56.31 20.33 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.311 0.505 . . . . 3.03 110.72 175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.59 -36.13 64.08 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 124.706 1.203 . . . . 0.54 111.783 -175.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.2 m -81.53 -46.91 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 109.467 -0.568 . . . . 2.01 109.467 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -53.04 -39.06 62.94 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 120.679 -1.263 . . . . 2.03 112.164 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -60.86 -17.62 51.25 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.866 1.061 . . . . 0.89 113.866 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 42.2 mt -56.81 -71.39 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.444 1.02 . . . . 0.55 112.045 -170.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 162.17 -69.7 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.383 2.273 . . . . 0.4 110.721 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.47 -44.63 3.2 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.792 2.139 . . . . 0.39 113.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -65.73 122.53 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 125.838 1.655 . . . . 0.35 111.273 -174.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -97.77 -60.1 1.63 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.857 1.263 . . . . 1.04 108.102 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -112.04 132.56 54.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.6 -1.63 . . . . 1.99 106.6 174.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.07 136.83 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 107.113 -1.44 . . . . 1.94 107.113 177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -143.82 87.55 1.92 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.105 -0.702 . . . . 2.15 109.105 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.735 HG12 HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER -95.89 104.78 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.546 1.139 . . . . 1.81 108.586 -179.332 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -98.78 88.15 3.96 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.401 -1.333 . . . . 0.58 107.401 178.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -60.36 167.57 2.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.067 -1.424 . . . . 2.02 110.522 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.19 -55.33 0.65 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.512 1.525 . . . . 0.58 110.787 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -71.04 1.26 5.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.849 1.26 . . . . 0.96 112.391 172.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 65.38 34.24 8.33 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 117.849 -1.072 . . . . 4.11 111.589 170.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.78 122.8 7.01 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 121.583 1.992 . . . . 3.12 111.515 -173.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -110.6 141.86 43.22 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.008 -1.849 . . . . 0.84 106.008 173.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.785 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -127.53 135.01 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.126 0 C-N-CA 130.022 3.329 . . . . 0.36 106.626 176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.772 HG23 HD11 ' A' ' 44' ' ' LEU . 1.6 t -125.39 124.2 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 125.813 1.645 . . . . 0.74 107.356 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -100.14 100.39 11.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.163 -2.162 . . . . 2.12 105.163 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.12 123.86 42.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.473 -0.936 . . . . 0.63 108.473 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -99.74 57.23 1.0 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.739 1.257 . . . . 3.22 107.921 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 40.0 t30 -166.36 -117.71 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 102.759 -3.052 . . . . 2.42 102.759 172.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.425 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 54.9 t0 -169.92 97.08 0.29 Allowed 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 107.624 -1.25 . . . . 1.75 107.624 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -127.96 -6.12 3.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 118.116 -0.945 . . . . 0.48 112.227 179.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -42.85 -50.23 5.73 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 120.031 1.287 . . . . 2.85 112.869 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.83 -37.42 66.14 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.522 1.153 . . . . 0.58 110.876 175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -42.66 81.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.394 1.478 . . . . 3.48 111.477 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.602 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 92.7 t -57.87 -55.5 21.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 123.893 0.877 . . . . 0.34 109.841 175.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -59.02 -45.06 91.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.927 -0.397 . . . . 3.09 109.927 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.4 t -51.46 -46.2 62.99 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.396 0.141 . . . . 1.08 110.949 169.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.9 -50.41 64.59 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.276 0.63 . . . . 0.46 110.132 -172.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 22' ' ' VAL . 7.9 mp -62.01 -47.16 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.454 1.102 . . . . 0.47 110.183 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -58.37 -45.45 88.22 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 110.189 -0.3 . . . . 1.57 110.189 178.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.8 mttt -63.75 -46.27 86.09 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.786 0.434 . . . . 2.96 111.948 175.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.62 -37.16 72.8 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.973 0.909 . . . . 0.5 110.725 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.33 40.44 0.36 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.299 0.952 . . . . 0.49 111.773 169.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -109.2 -176.5 3.05 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.85 1.26 . . . . 1.9 109.271 174.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 70.5 m -151.62 68.1 0.9 Allowed 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 107.247 -1.39 . . . . 1.62 107.247 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.3 OUTLIER -81.63 -179.39 7.36 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.126 -0.943 . . . . 2.11 112.567 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.8 ttt180 -146.42 156.67 43.48 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.126 -1.064 . . . . 3.29 108.126 164.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -62.4 133.21 54.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.018 1.727 . . . . 4.11 110.49 175.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -111.42 60.9 0.61 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.011 0.924 . . . . 2.39 108.542 167.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 56.5 mm-40 60.66 -178.79 0.1 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.002 0.921 . . . . 3.85 112.263 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.27 83.4 1.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.535 1.134 . . . . 2.02 108.463 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 73.79 52.2 0.11 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 2.54 113.498 171.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 107.139 -1.43 . . . . 7.02 107.139 156.038 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.956 -0.387 . . . . 3.93 109.956 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.85 -104.54 1.61 Allowed Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.417 -1.873 . . . . 2.2 108.417 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 88.2 m -142.07 132.73 25.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.058 -1.26 . . . . 1.57 108.734 165.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.431 HH21 ' C ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -96.33 115.52 27.56 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 106.314 -1.736 . . . . 3.6 106.314 174.066 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 91.7 m-85 -112.31 155.69 23.68 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.16 0.984 . . . . 2.16 110.855 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -132.87 152.82 51.78 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.758 1.223 . . . . 1.43 112.769 171.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.4 m-90 -139.28 149.71 44.6 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.234 1.013 . . . . 0.61 111.312 170.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -97.7 88.75 4.41 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 124.132 0.895 . . . . 1.56 112.906 -174.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.27 82.14 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.868 0.842 . . . . 2.97 112.319 -163.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 t -59.19 -27.83 66.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.59 0.71 . . . . 3.02 112.817 -172.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.8 -13.69 75.33 Favored Glycine 0 CA--C 1.535 1.293 0 CA-C-O 118.846 -0.974 . . . . 1.73 114.35 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.97 110.13 18.67 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.471 1.636 . . . . 5.18 112.176 -174.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 p-10 -120.77 -37.21 3.03 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.263 2.225 . . . . 1.5 113.614 -161.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -125.38 161.06 27.88 Favored 'General case' 0 CA--C 1.527 0.094 0 C-N-CA 126.527 1.931 . . . . 0.67 109.978 -172.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.08 -37.72 81.56 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.12 -0.363 . . . . 0.38 111.194 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.43 72.97 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.506 -0.747 . . . . 0.47 109.983 177.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.9 m -50.12 -58.26 5.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.124 1.369 . . . . 0.66 108.899 172.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.18 -47.13 17.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.71 0.804 . . . . 0.3 111.199 175.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -69.59 -36.4 76.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 112.375 0.509 . . . . 3.3 112.375 -176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -57.9 -42.45 84.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.837 -0.801 . . . . 2.62 108.837 173.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -70.93 -47.74 60.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 118.518 -0.753 . . . . 0.79 111.475 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -53.79 -42.22 68.1 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.367 -0.975 . . . . 2.07 108.367 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -64.4 -55.55 20.27 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.865 -0.607 . . . . 2.76 110.503 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.56 60.11 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 124.259 1.024 . . . . 0.61 111.939 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.57 -50.13 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 117.911 0.323 . . . . 1.79 110.3 172.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -53.58 -39.57 64.93 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.678 -0.639 . . . . 1.83 111.767 -173.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -60.33 -16.59 36.24 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.93 1.085 . . . . 1.05 113.93 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.2 mt -61.71 -72.28 0.13 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.741 1.155 . . . . 0.64 111.854 -171.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 165.68 -68.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.677 1.991 . . . . 0.52 110.668 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.45 -39.45 7.59 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 126.49 1.995 . . . . 0.49 114.479 -175.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -70.64 123.94 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 C-N-CA 125.484 1.514 . . . . 0.46 110.98 -173.554 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -98.35 -55.33 2.79 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 107.887 -1.153 . . . . 0.96 107.887 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -118.34 121.13 39.63 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.581 -1.266 . . . . 2.32 107.581 176.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.6 p -94.38 149.65 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.54 -0.911 . . . . 1.84 108.54 173.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -154.15 87.69 1.21 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.256 0.623 . . . . 2.0 110.224 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.611 HG22 HD13 ' A' ' 44' ' ' LEU . 95.8 t -92.15 100.81 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.118 -1.067 . . . . 2.39 108.118 178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 35.6 tp -97.19 82.47 3.18 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.082 1.42 . . . . 0.53 107.611 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -58.96 167.88 1.48 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.925 -1.488 . . . . 1.84 111.259 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.91 -47.82 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 126.626 1.97 . . . . 0.67 110.517 -177.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 22.8 p -75.74 0.2 18.71 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.16 0.8 . . . . 2.64 113.16 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 59.82 45.82 12.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.914 0.886 . . . . 4.02 110.148 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -158.81 125.81 4.8 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 120.1 -1.625 . . . . 3.15 110.949 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.611 HD13 HG22 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -122.63 130.65 53.23 Favored 'General case' 0 N--CA 1.425 -1.675 0 N-CA-C 104.109 -2.552 . . . . 0.9 104.109 -175.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.582 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -116.63 145.2 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.825 2.45 . . . . 0.29 107.087 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.9 t -138.24 126.27 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 N-CA-C 106.508 -1.664 . . . . 0.62 106.508 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -99.48 101.77 13.12 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 103.908 -2.627 . . . . 3.5 103.908 169.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.57 133.59 53.24 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 107.615 -1.254 . . . . 0.7 107.615 -174.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -111.55 56.9 0.64 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.632 1.206 . . . . 3.61 108.276 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -165.07 -124.53 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.594 -2.743 . . . . 2.54 103.594 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -151.27 24.61 0.72 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.241 1.382 . . . . 2.51 112.226 -171.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.7 pp -63.27 -20.22 25.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-O 117.657 -1.163 . . . . 0.83 113.276 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -43.24 -41.39 3.85 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 121.291 1.86 . . . . 2.24 114.826 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.93 84.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.465 1.029 . . . . 0.55 109.355 176.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -58.01 -49.87 75.36 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.331 1.453 . . . . 3.56 110.597 170.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 55.3 t -58.87 -52.4 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 124.516 1.127 . . . . 0.85 109.204 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HA ' HD21 ' A' ' 67' ' ' LEU . 6.1 tm-20 -55.0 -60.16 3.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 107.799 -1.186 . . . . 3.89 107.799 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.9 t -52.93 -43.44 66.28 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 122.964 0.505 . . . . 1.14 110.542 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.84 80.8 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.648 0.779 . . . . 0.91 110.498 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 4.3 mp -66.32 -46.1 78.05 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 122.675 0.39 . . . . 0.76 110.017 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -57.66 -42.92 84.47 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.238 -0.652 . . . . 4.78 109.238 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.52 -49.67 72.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.53 1.132 . . . . 3.64 112.086 173.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 -29.53 60.68 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.342 1.057 . . . . 1.31 110.668 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 112.93 28.14 3.5 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 124.443 1.021 . . . . 1.16 111.052 168.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -98.77 170.93 8.42 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.246 -1.02 . . . . 2.52 108.246 171.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 55.8 m -122.15 71.3 1.0 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.108 -1.441 . . . . 1.86 107.108 -175.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.623 HD13 HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -85.67 165.16 17.2 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 123.897 0.748 . . . . 1.82 110.524 165.241 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -156.03 151.88 27.4 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 106.899 -1.519 . . . . 4.4 106.899 157.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -70.4 102.59 2.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.359 2.264 . . . . 3.7 113.443 -168.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -85.25 62.08 7.27 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.647 -0.871 . . . . 3.12 108.647 168.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 61.96 173.44 0.13 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.998 1.719 . . . . 3.88 114.392 168.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.72 52.02 2.22 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.403 -1.271 . . . . 1.97 109.731 173.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 155.09 165.67 0.01 OUTLIER 'General case' 0 C--N 1.339 0.112 0 C-N-CA 127.667 2.387 . . . . 4.2 108.934 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.431 ' C ' HH21 ' A' ' 5' ' ' ARG . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.424 0 C-N-CA 130.707 3.603 . . . . 10.89 101.438 -153.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 110.088 -0.338 . . . . 4.53 110.088 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 65.55 -168.88 30.44 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 108.958 -1.657 . . . . 1.39 108.958 -163.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.78 169.52 16.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.149 -2.537 . . . . 1.95 104.149 148.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -129.86 135.14 48.04 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.544 -2.021 . . . . 2.37 105.544 163.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.795 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.7 m-85 -128.75 153.69 47.12 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.779 -1.563 . . . . 2.01 106.779 175.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 70.3 m -136.26 152.31 50.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.279 0.945 . . . . 1.59 112.188 176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.795 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.1 m-90 -133.19 136.55 45.73 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.285 1.434 . . . . 0.39 109.454 171.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -98.42 139.55 34.0 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 105.79 -1.93 . . . . 1.86 105.79 173.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.9 p -134.91 174.53 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.055 0.542 . . . . 1.81 111.454 -174.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.5 p -138.12 71.19 1.39 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.568 -1.271 . . . . 2.77 107.568 174.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.77 -53.56 0.06 OUTLIER Glycine 0 CA--C 1.53 1.006 0 C-N-CA 120.595 -0.812 . . . . 1.31 113.289 -173.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HG2' HG21 ' A' ' 22' ' ' VAL . 8.3 mtp -56.43 108.16 0.45 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.27 1.028 . . . . 2.23 113.072 -174.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 p-10 -130.26 -23.82 2.64 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.455 1.902 . . . . 1.37 114.553 -161.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.5 m -132.24 157.27 44.81 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.393 1.477 . . . . 0.63 109.131 -172.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.14 92.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.391 0.277 . . . . 0.34 111.209 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.66 -56.02 27.15 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.584 -0.524 . . . . 0.31 109.584 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.555 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.2 m -46.23 -54.34 8.98 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.024 1.33 . . . . 0.51 109.128 172.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.22 -55.1 19.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.68 0.792 . . . . 0.28 111.652 178.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -38.49 76.57 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 121.654 -0.654 . . . . 5.07 111.106 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -63.23 -42.48 99.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.618 -0.512 . . . . 4.13 109.618 176.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 18' ' ' CYS . 86.3 t -63.54 -56.35 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 123.984 0.913 . . . . 0.55 108.981 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -59.09 -37.55 77.4 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.179 -1.008 . . . . 2.33 110.144 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.25 -50.01 73.42 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.605 0.639 . . . . 2.89 111.306 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.68 -33.56 55.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.577 1.151 . . . . 0.44 111.469 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 56' ' ' VAL . 21.4 t -79.2 -52.29 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.741 0.417 . . . . 2.16 111.071 171.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -58.15 -33.28 69.01 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.157 0.983 . . . . 2.09 111.693 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.09 -15.77 15.75 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.743 1.016 . . . . 0.82 113.743 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 68.6 mt -63.51 -78.41 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.698 1.136 . . . . 0.55 111.561 -174.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 164.85 -69.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.545 1.938 . . . . 0.33 110.877 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.4 -44.53 15.87 Favored Glycine 0 C--N 1.341 0.826 0 C-N-CA 125.627 1.584 . . . . 0.31 113.267 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.6 OUTLIER -66.69 125.57 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 C-N-CA 124.563 1.145 . . . . 0.38 111.459 -174.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -100.57 -63.64 1.11 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.467 1.107 . . . . 1.19 109.232 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -110.91 127.7 55.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.896 -1.891 . . . . 1.81 105.896 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.67 134.71 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.189 -1.411 . . . . 2.36 107.189 174.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -124.75 102.42 7.57 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 106.792 -1.558 . . . . 2.47 106.792 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.07 121.07 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.818 0 N-CA-C 106.091 -1.818 . . . . 2.85 106.091 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.4 tp -119.23 82.06 1.81 Allowed 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.684 -1.599 . . . . 0.52 106.684 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -59.38 168.52 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.056 -1.429 . . . . 1.84 110.237 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.23 -59.37 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.198 1.399 . . . . 0.55 110.077 -175.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.3 m -80.34 50.84 1.32 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.142 0.977 . . . . 1.3 108.916 170.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 7.98 45.75 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 1 C-N-CA 132.292 4.237 . . . . 4.2 119.518 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.87 160.88 42.34 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 120.439 1.472 . . . . 2.14 114.406 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.57 HD12 ' N ' ' A' ' 45' ' ' VAL 0.304 0.5 OUTLIER -138.0 143.67 40.74 Favored 'General case' 0 N--CA 1.419 -2.022 0 N-CA-C 105.048 -2.204 . . . . 0.92 105.048 -178.669 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.57 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.8 t -128.37 136.43 60.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 130.716 3.606 . . . . 0.32 104.73 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 52' ' ' ILE . 2.3 t -129.18 132.56 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 106.798 -1.556 . . . . 0.76 106.798 -178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.35 106.95 14.92 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 104.461 -2.422 . . . . 2.08 104.461 173.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.74 144.32 50.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.093 1.357 . . . . 0.94 107.428 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.98 56.65 0.9 Allowed 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 106.894 -1.521 . . . . 2.61 106.894 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -158.99 -98.62 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 103.393 -2.818 . . . . 2.51 103.393 168.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.0 t70 169.51 125.01 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.849 2.46 . . . . 2.09 105.928 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.494 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -155.43 18.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 124.321 1.048 . . . . 0.4 110.904 -174.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 -46.32 68.97 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 120.18 -1.575 . . . . 2.37 109.317 -169.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.41 -17.13 64.3 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.465 -1.243 . . . . 0.63 111.52 173.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -77.68 -47.36 19.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.358 -0.839 . . . . 2.85 110.824 165.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 50.7 t -53.66 -53.62 24.64 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 C-N-CA 124.821 1.249 . . . . 0.4 110.141 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.535 ' HA ' HD21 ' A' ' 67' ' ' LEU . 1.7 pp20? -57.37 -47.87 80.52 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.325 -0.852 . . . . 3.92 108.816 -173.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -44.46 95.33 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 123.905 0.882 . . . . 1.25 109.906 175.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.78 -48.02 80.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.488 0.661 . . . . 0.44 109.392 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.431 HD21 ' CD2' ' A' ' 44' ' ' LEU . 7.2 mp -66.04 -42.81 89.05 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.653 1.181 . . . . 0.59 111.756 178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -59.98 -44.65 94.35 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 122.968 0.507 . . . . 1.54 110.09 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -66.0 -44.25 85.37 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.702 0.401 . . . . 3.74 110.301 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.58 -37.88 73.91 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.941 -0.474 . . . . 0.56 111.424 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.0 42.16 0.26 Allowed Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.799 1.19 . . . . 0.48 112.22 170.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.464 ' CE2' HG22 ' A' ' 22' ' ' VAL . 78.3 m-85 -115.49 -177.09 3.06 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.894 1.278 . . . . 1.84 109.265 174.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m -146.85 69.82 1.19 Allowed 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.206 -1.405 . . . . 1.66 107.206 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 ' C ' ' A' ' 67' ' ' LEU . 1.5 pp -79.76 175.97 10.15 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.148 -0.478 . . . . 2.01 111.218 -177.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.83 141.22 30.25 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.184 -0.673 . . . . 4.27 109.184 163.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -34.03 128.35 0.38 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.121 1.768 . . . . 4.16 111.997 163.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -121.76 58.77 1.0 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 1.85 108.582 170.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 58.31 -173.54 0.09 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.265 0.555 . . . . 3.84 111.067 177.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.13 69.23 1.48 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.549 0.739 . . . . 1.9 109.693 -173.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.65 116.39 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.297 1.439 . . . . 2.78 111.804 -172.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 C--O 1.254 1.302 0 CA-C-O 116.758 -1.591 . . . . 6.7 108.699 -169.186 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 109.259 -0.645 . . . . 5.01 109.259 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -175.93 -177.71 45.17 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 107.922 -2.071 . . . . 1.39 107.922 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 49.9 m -113.29 122.56 47.79 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 125.072 1.349 . . . . 1.42 108.678 173.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.579 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -97.28 133.85 41.35 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 124.052 0.845 . . . . 2.76 108.963 162.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.774 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 18.1 m-85 -104.74 178.03 4.68 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 125.99 1.716 . . . . 2.06 109.063 168.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -150.6 152.95 34.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.774 0.829 . . . . 1.61 110.723 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.774 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 9.7 m-90 -135.03 145.88 48.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.166 1.386 . . . . 0.35 109.277 173.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -102.02 121.95 43.15 Favored 'General case' 0 C--N 1.337 0.033 0 C-N-CA 124.693 1.197 . . . . 1.96 107.877 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.0 100.67 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 119.46 1.027 . . . . 2.03 113.433 -168.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -75.76 84.35 2.74 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.284 -1.006 . . . . 1.79 108.284 176.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 173.72 -35.53 0.12 Allowed Glycine 0 CA--C 1.531 1.054 0 N-CA-C 114.652 0.621 . . . . 1.42 114.652 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 mtm -77.22 111.13 12.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.697 1.249 . . . . 2.14 112.264 -173.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -121.42 -7.82 9.19 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.38 1.472 . . . . 1.42 114.886 -171.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -136.24 149.33 48.47 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.418 1.008 . . . . 0.64 109.439 -166.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.42 87.14 Favored 'General case' 0 C--O 1.225 -0.192 0 O-C-N 122.481 -0.137 . . . . 0.35 110.787 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.16 78.62 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.973 -0.454 . . . . 0.26 110.22 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.33 -52.89 50.65 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.227 1.011 . . . . 0.5 108.947 172.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.14 -50.89 58.03 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 122.337 -0.227 . . . . 0.25 111.399 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.68 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.571 -0.705 . . . . 3.44 111.705 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.8 tptt -57.48 -48.5 79.05 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.983 -0.747 . . . . 2.78 108.983 174.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.446 HG13 HD11 ' A' ' 60' ' ' LEU . 76.1 t -71.18 -49.73 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 124.451 1.1 . . . . 0.68 110.467 -172.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -53.88 -44.97 70.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.6 -0.889 . . . . 1.83 108.6 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -63.85 -51.52 64.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.782 -0.19 . . . . 2.59 110.811 178.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.47 -33.36 65.86 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.732 1.213 . . . . 0.52 112.196 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 HG13 ' A' ' 56' ' ' VAL . 13.8 m -81.4 -45.62 20.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 118.335 0.516 . . . . 1.82 110.606 170.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.3 ttt-85 -56.55 -34.23 66.9 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.337 -0.852 . . . . 3.26 111.833 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -59.69 -18.4 42.02 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.804 1.038 . . . . 0.89 113.804 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 72.5 mt -59.53 -71.26 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.422 1.01 . . . . 0.44 112.273 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.36 -71.64 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.086 2.154 . . . . 0.35 110.631 -178.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -39.7 -47.01 3.05 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.272 1.891 . . . . 0.32 113.066 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.8 OUTLIER -69.32 123.01 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 124.85 1.26 . . . . 0.33 112.258 -169.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -99.43 -53.8 3.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.768 1.627 . . . . 1.06 109.131 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.39 135.41 55.05 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 106.445 -1.687 . . . . 2.4 106.445 173.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.0 p -114.97 143.25 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.949 -1.13 . . . . 1.97 107.949 176.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -145.61 90.84 2.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.694 -0.854 . . . . 2.35 108.694 175.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.653 HG12 HD13 ' A' ' 44' ' ' LEU . 1.4 m -96.02 107.11 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.697 -0.853 . . . . 1.77 108.697 177.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.2 tp -99.1 90.17 4.51 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.472 -1.307 . . . . 0.66 107.472 179.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -62.77 173.86 1.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.093 -1.412 . . . . 1.88 110.728 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 69.77 -66.19 0.28 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.45 1.5 . . . . 0.86 109.208 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 m -78.81 45.91 0.64 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.323 1.049 . . . . 1.33 110.096 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 9.69 49.33 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 131.193 3.797 . . . . 4.27 118.097 177.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.13 134.68 20.92 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 121.053 1.751 . . . . 2.34 110.49 -178.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -123.34 141.57 51.85 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 105.3 -2.111 . . . . 0.66 105.3 -179.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.671 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -126.99 141.32 46.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 128.958 2.903 . . . . 0.4 105.942 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 14.3 t -139.53 129.71 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.477 -1.675 . . . . 0.68 106.477 -178.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.45 109.26 21.39 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.125 -2.176 . . . . 1.78 105.125 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -143.55 113.91 7.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.883 0.849 . . . . 1.26 111.767 -173.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -107.91 57.5 0.62 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.374 -1.285 . . . . 2.62 107.933 -162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -151.11 -71.24 0.17 Allowed 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 105.941 -1.874 . . . . 2.6 105.941 172.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 47.5 t0 148.47 115.75 0.0 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 131.512 3.925 . . . . 2.32 105.699 175.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.507 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -147.11 -8.84 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 C-N-CA 124.601 1.16 . . . . 0.39 113.635 176.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.82 -42.59 3.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 121.765 2.075 . . . . 2.88 112.846 175.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.72 -23.55 64.36 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.574 0.35 . . . . 0.56 111.879 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -71.84 -49.43 38.44 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.33 -0.856 . . . . 3.19 111.381 161.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.697 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 75.4 t -52.49 -55.07 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 123.916 0.886 . . . . 0.34 109.847 -176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.713 ' HB2' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.59 -45.87 84.71 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.575 -0.739 . . . . 2.98 110.052 -175.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.83 -40.16 91.75 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 116.094 -0.503 . . . . 0.95 109.99 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -50.61 67.18 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.677 0.791 . . . . 0.39 109.608 -176.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 HD13 ' A' ' 67' ' ' LEU . 6.7 mp -56.1 -46.92 78.91 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.619 0.768 . . . . 0.61 110.218 173.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.79 -42.26 98.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 121.879 -0.513 . . . . 1.48 111.232 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -64.41 -45.91 85.52 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.174 0.99 . . . . 3.49 110.69 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.24 -38.67 84.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.63 0.772 . . . . 0.54 110.929 177.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 45.98 0.24 Allowed Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.62 1.105 . . . . 0.45 112.181 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -119.55 165.38 14.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.502 1.121 . . . . 1.85 110.397 176.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 72.0 m -122.33 80.68 1.75 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.609 1.564 . . . . 1.37 107.966 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.713 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.68 171.21 13.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.514 -0.766 . . . . 1.86 113.019 171.131 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -151.04 144.56 24.94 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.989 -0.745 . . . . 3.22 108.989 162.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.34 135.13 57.55 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 125.128 1.371 . . . . 3.07 112.299 -176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -120.99 56.43 1.01 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.358 1.063 . . . . 2.51 110.821 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 70.01 147.92 0.07 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.293 1.837 . . . . 3.79 112.398 166.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -77.98 71.45 4.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.289 -0.869 . . . . 2.16 109.378 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 75.19 89.24 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.721 1.208 . . . . 2.55 111.538 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 . . . . . 0 C--O 1.257 1.488 0 N-CA-C 106.429 -1.693 . . . . 7.47 106.429 166.258 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.753 0.311 . . . . 4.99 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.4 -167.26 17.45 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 108.25 -1.94 . . . . 1.86 108.25 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.3 m -113.17 104.53 12.44 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 105.421 -2.066 . . . . 1.18 105.421 -163.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.24 111.95 23.96 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 106.502 -1.666 . . . . 2.95 106.502 -172.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.83 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 55.9 m-85 -107.6 157.42 18.08 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 108.263 -1.014 . . . . 2.05 108.263 175.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.22 151.18 43.54 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.401 0.68 . . . . 2.15 110.145 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.83 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 12.6 m-90 -133.5 136.55 45.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.444 1.097 . . . . 0.37 109.092 175.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -98.22 144.84 27.23 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 105.883 -1.895 . . . . 1.66 105.883 170.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -132.96 178.01 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.07 1.348 . . . . 2.01 109.55 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.6 p -123.52 12.42 9.33 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.239 1.016 . . . . 2.96 111.55 172.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -121.84 -122.86 2.88 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 109.474 -1.45 . . . . 2.74 109.474 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 37.1 mtm 42.29 70.72 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.051 1.34 . . . . 2.47 113.507 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -111.49 -9.7 14.2 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 128.05 2.54 . . . . 1.56 113.649 -167.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -137.22 152.74 50.19 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.367 1.067 . . . . 0.74 109.417 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.84 -41.38 97.75 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 122.851 0.461 . . . . 0.55 110.482 172.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.55 -46.03 90.08 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.818 -0.552 . . . . 0.35 110.358 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.609 ' O ' HG23 ' A' ' 22' ' ' VAL . 80.7 m -55.51 -55.89 26.62 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.309 1.044 . . . . 0.62 108.888 173.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PHE . . . -46.35 -47.08 18.67 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 123.696 0.798 . . . . 0.38 111.042 175.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -69.17 -42.15 76.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.356 0.598 . . . . 3.42 111.182 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.74 -40.59 80.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.589 -0.694 . . . . 3.59 109.36 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 18' ' ' CYS . 60.4 t -64.84 -53.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 108.423 -0.955 . . . . 0.51 108.423 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.48 -39.68 84.5 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.488 -0.93 . . . . 1.85 108.488 -172.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -66.22 -45.64 80.02 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.507 0.723 . . . . 2.75 111.176 176.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.13 70.8 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 124.535 1.134 . . . . 0.52 111.455 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.46 ' CG1' HG13 ' A' ' 56' ' ' VAL . 2.9 m -83.92 -45.43 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 110.039 -0.356 . . . . 1.87 110.039 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -54.21 -42.04 69.32 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.249 -0.907 . . . . 3.71 111.08 -175.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -59.97 -16.07 27.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.087 1.143 . . . . 0.83 114.087 -178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 82.9 mt -55.86 -69.21 0.15 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.58 1.082 . . . . 0.48 112.226 -171.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.97 -65.52 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 127.742 2.417 . . . . 0.53 109.501 178.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.02 -49.59 6.3 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.912 1.72 . . . . 0.65 113.354 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.87 128.3 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 C-N-CA 124.291 1.036 . . . . 0.48 112.34 -167.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -96.77 -46.69 6.17 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.814 1.246 . . . . 0.98 108.963 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -135.92 136.1 40.2 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.761 -0.829 . . . . 2.65 108.761 173.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.8 m -96.69 145.73 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 124.756 1.222 . . . . 2.43 109.068 173.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -144.7 85.41 1.77 Allowed 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.304 -0.998 . . . . 2.3 108.304 169.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.694 HG22 HD13 ' A' ' 44' ' ' LEU . 87.1 t -92.98 110.03 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 107.742 -1.207 . . . . 2.23 107.742 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 31.7 tp -107.44 82.3 1.65 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.277 -1.008 . . . . 0.68 108.277 176.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 19' ' ' ALA . 3.4 p90 -60.28 167.4 2.47 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.57 -1.196 . . . . 1.95 110.527 172.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.93 -54.68 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.258 1.823 . . . . 0.65 111.284 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.8 m -64.13 -16.57 62.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.765 1.226 . . . . 1.28 111.01 166.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 72.33 39.99 0.71 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.404 1.082 . . . . 3.12 111.098 167.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.53 153.27 38.19 Favored 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 121.139 -0.976 . . . . 3.06 111.086 169.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.694 HD13 HG22 ' A' ' 37' ' ' VAL 0.257 0.2 OUTLIER -130.63 141.63 50.43 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 104.231 -2.507 . . . . 0.77 104.231 178.48 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.67 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -128.92 140.47 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 129.091 2.957 . . . . 0.32 105.226 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG11 HD11 ' A' ' 52' ' ' ILE . 2.2 t -132.47 130.6 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.203 -1.777 . . . . 0.6 106.203 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -103.54 102.3 12.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 103.897 -2.631 . . . . 2.37 103.897 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.71 112.69 7.35 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.352 0.596 . . . . 1.19 111.163 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -107.59 57.79 0.62 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.858 1.314 . . . . 2.84 109.13 -162.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -99.19 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 104.288 -2.486 . . . . 3.51 104.288 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -173.98 99.77 0.1 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.998 0.817 . . . . 2.28 109.891 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.561 HD11 HG11 ' A' ' 46' ' ' VAL . 2.9 pp -141.37 -14.2 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-O 117.29 -1.338 . . . . 0.47 114.412 178.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.442 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 1.7 ptt180 -43.33 -42.56 4.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 121.677 2.035 . . . . 2.7 112.617 173.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.65 -22.3 63.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.047 0.539 . . . . 0.81 112.037 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -71.66 -47.8 51.87 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.403 -0.811 . . . . 3.01 111.781 159.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.627 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 95.5 t -54.61 -53.25 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 124.018 0.927 . . . . 0.33 109.728 -174.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.03 -54.99 35.97 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.575 -0.739 . . . . 3.11 109.892 -176.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 t -52.11 -44.11 64.3 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.251 1.02 . . . . 0.86 111.021 172.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.56 -48.36 75.31 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.584 0.754 . . . . 0.32 110.251 -174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.45 ' CD2' HD23 ' A' ' 67' ' ' LEU . 6.5 mp -62.39 -43.69 98.22 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.449 1.1 . . . . 0.5 110.423 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.12 -43.68 87.34 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 122.264 0.225 . . . . 1.48 110.64 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 mttt -66.49 -43.8 84.39 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.511 0.724 . . . . 3.11 111.535 176.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.35 -39.63 87.81 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.624 0.77 . . . . 0.49 110.812 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.03 46.11 0.21 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 124.542 1.068 . . . . 0.51 112.006 170.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -120.05 165.56 14.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.546 1.139 . . . . 1.86 109.105 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.3 m -123.99 71.81 1.13 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.892 -0.781 . . . . 1.55 108.892 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.525 HD22 ' HB3' ' A' ' 8' ' ' TRP . 0.2 OUTLIER -82.81 179.87 7.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.941 0.719 . . . . 2.07 112.941 179.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -155.09 145.14 21.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.293 -1.373 . . . . 4.32 107.293 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.51 130.46 31.84 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.406 1.082 . . . . 2.87 110.603 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -117.67 61.22 0.76 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.597 1.159 . . . . 1.93 109.574 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 66.28 174.14 0.24 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 122.802 1.287 . . . . 5.47 111.742 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -126.51 103.11 7.42 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 105.474 -2.047 . . . . 1.93 105.474 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.9 124.23 24.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.149 -1.056 . . . . 4.86 108.149 171.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 128.569 2.748 . . . . 11.24 104.388 -175.67 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 109.555 -0.535 . . . . 4.03 109.555 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.55 -128.36 0.4 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.682 -0.967 . . . . 1.72 110.682 -170.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 54.2 m -144.47 123.01 12.44 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.76 -1.57 . . . . 1.15 106.76 168.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.79 106.76 18.68 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 103.846 -2.649 . . . . 3.44 103.846 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.847 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 68.6 m-85 -102.34 152.44 21.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.727 -1.212 . . . . 2.15 107.727 169.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.9 t -133.4 155.18 49.97 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 118.283 0.492 . . . . 1.58 110.57 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.847 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 5.3 m-90 -132.32 143.2 49.7 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.232 2.213 . . . . 0.36 108.196 174.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -107.24 133.72 51.4 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 104.925 -2.25 . . . . 1.64 104.925 175.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 m -116.43 -177.79 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 O-C-N 123.935 0.772 . . . . 2.49 110.05 -174.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 t -153.56 97.1 2.09 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 105.997 -1.853 . . . . 1.85 105.997 166.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 161.03 -48.95 0.37 Allowed Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.402 -0.279 . . . . 1.57 112.402 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.6 mtp -64.23 117.02 6.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.428 0.691 . . . . 2.58 112.556 -169.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.7 p-10 -131.33 -28.13 1.92 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.766 2.426 . . . . 1.26 113.288 -151.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -126.58 152.38 46.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 126.044 1.738 . . . . 0.76 109.22 -173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.0 -36.87 80.6 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.609 0.363 . . . . 0.35 110.974 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.92 41.47 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.902 -0.499 . . . . 0.31 109.865 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.5 m -52.27 -54.64 28.79 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.128 1.371 . . . . 0.63 108.969 176.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.6 -50.19 24.85 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.865 1.266 . . . . 0.47 110.91 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -68.45 -38.51 81.2 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.546 0.688 . . . . 3.7 110.835 -177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -57.25 -39.31 75.35 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.216 -0.928 . . . . 3.66 108.71 176.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 18' ' ' CYS . 24.1 t -66.94 -50.54 63.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.379 0.672 . . . . 0.51 110.001 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -57.63 -42.57 83.62 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 108.698 -0.853 . . . . 1.82 108.698 -174.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -62.3 -49.88 73.88 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.5 1.52 . . . . 3.07 110.986 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.07 -37.37 64.13 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.78 0.832 . . . . 0.41 111.511 179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.541 ' CG2' HG13 ' A' ' 56' ' ' VAL . 27.9 t -81.39 -49.89 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 122.329 0.252 . . . . 2.15 111.167 176.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -56.73 -33.97 67.04 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.524 -0.735 . . . . 1.84 111.569 -169.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.2 -17.92 59.55 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.035 1.124 . . . . 0.84 114.035 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 87.7 mt -59.03 -75.14 0.06 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.411 1.005 . . . . 0.42 112.586 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.97 -73.21 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.359 1.864 . . . . 0.39 110.782 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.88 -46.44 3.93 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 126.29 1.9 . . . . 0.34 113.38 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.56 121.85 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 124.671 1.189 . . . . 0.31 111.788 -171.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -98.41 -53.74 3.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.68 1.192 . . . . 1.04 108.642 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -118.18 132.07 56.35 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.551 -1.648 . . . . 1.86 106.551 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 p -111.44 145.41 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 106.959 -1.497 . . . . 2.3 106.959 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -141.18 100.31 3.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.107 -1.071 . . . . 1.89 108.107 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.599 HG22 HD13 ' A' ' 44' ' ' LEU . 78.5 t -95.48 107.87 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.55 107.839 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 54.1 tp -100.74 86.03 3.02 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.503 -1.295 . . . . 0.6 107.503 171.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -63.29 172.23 2.03 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.709 -1.132 . . . . 1.92 110.008 171.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.25 -65.31 0.27 Allowed 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.046 1.339 . . . . 0.71 109.841 -176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -79.89 53.56 1.69 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.308 1.043 . . . . 1.43 108.92 168.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -8.83 57.26 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.657 1 C-N-CA 133.062 4.545 . . . . 3.39 119.05 -176.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.83 146.91 28.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 O-C-N 120.658 -1.276 . . . . 2.28 111.393 178.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.599 HD13 HG22 ' A' ' 37' ' ' VAL 0.265 0.6 OUTLIER -135.41 127.8 30.37 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.21 -2.144 . . . . 0.83 105.21 -175.759 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.44 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.6 t -115.9 141.66 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 C-N-CA 129.537 3.135 . . . . 0.35 105.571 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 52' ' ' ILE . 54.0 t -135.16 129.9 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 108.047 -1.094 . . . . 0.7 108.047 177.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -99.68 102.99 14.63 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.301 -2.481 . . . . 2.26 104.301 171.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.4 122.49 37.81 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.272 -1.01 . . . . 0.67 108.272 -178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.93 56.02 1.21 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 106.085 -1.82 . . . . 2.51 106.085 -174.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -162.74 -70.19 0.05 OUTLIER 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.852 1.261 . . . . 2.57 109.141 175.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 135.64 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 130.548 3.539 . . . . 2.13 107.21 -173.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.513 HD11 HG11 ' A' ' 46' ' ' VAL . 2.3 pp -145.72 2.88 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.165 0.986 . . . . 0.42 111.758 173.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ptt85 -53.44 -37.27 62.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 120.05 1.295 . . . . 3.0 112.136 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.35 -29.99 66.82 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.859 0.362 . . . . 0.41 110.876 176.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -63.98 -49.23 73.31 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.307 -0.87 . . . . 3.45 110.82 164.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.666 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 81.3 t -51.37 -55.12 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 118.402 0.546 . . . . 0.35 109.613 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.774 ' HB2' HD21 ' A' ' 67' ' ' LEU . 1.3 pp20? -66.97 -45.13 78.65 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.809 -0.632 . . . . 3.07 109.689 -168.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.1 t -54.85 -43.25 72.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.716 0.406 . . . . 0.89 110.689 170.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -47.47 69.95 Favored 'General case' 0 N--CA 1.461 0.103 0 O-C-N 121.917 -0.489 . . . . 0.48 110.345 -174.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 44' ' ' LEU . 6.2 mp -61.24 -42.66 99.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.695 1.198 . . . . 0.69 110.475 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -61.53 -42.19 98.45 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 110.274 -0.269 . . . . 1.49 110.274 175.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.51 -49.17 78.33 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.615 0.366 . . . . 3.43 111.077 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.86 -34.91 76.85 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.292 0.637 . . . . 0.48 111.114 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 119.36 44.08 0.49 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.135 1.35 . . . . 0.45 111.872 170.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.47 ' CE2' HG22 ' A' ' 22' ' ' VAL . 57.7 m-85 -121.82 147.84 45.45 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.415 1.086 . . . . 2.24 110.152 177.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 44.0 m -106.85 66.44 0.68 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.125 1.37 . . . . 1.67 109.119 -167.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.774 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.77 168.89 17.56 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.74 1.385 . . . . 1.83 114.74 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.29 150.14 30.19 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.421 -0.955 . . . . 4.09 108.421 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -44.33 133.41 5.51 Favored 'General case' 0 C--N 1.342 0.272 0 C-N-CA 125.538 1.535 . . . . 2.97 111.183 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.73 51.45 2.13 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 122.107 0.956 . . . . 2.42 108.634 169.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 63.8 147.86 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.086 2.555 . . . . 3.66 115.227 167.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.43 74.96 9.28 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 114.303 -1.317 . . . . 2.02 108.954 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 61.83 -152.06 0.37 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.757 1.223 . . . . 2.64 111.156 177.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 128.461 2.705 . . . . 6.31 104.033 173.827 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.508 0.194 . . . . 4.6 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 156.52 -149.5 20.38 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.546 -2.621 . . . . 1.17 106.546 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -141.39 127.4 19.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.477 1.139 . . . . 0.96 108.264 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -96.74 102.94 14.81 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.479 -1.304 . . . . 2.4 107.479 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 15.1 m-85 -97.19 158.11 15.61 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 124.582 1.153 . . . . 1.9 110.242 177.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.9 m -138.49 151.05 47.03 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.047 0.839 . . . . 1.86 111.377 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.717 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 21.4 m-90 -133.47 139.84 46.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.63 1.172 . . . . 0.43 109.066 170.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.08 137.89 35.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 106.123 -1.806 . . . . 2.99 106.123 169.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 11' ' ' SER . 9.3 p -118.19 -177.57 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.195 0.998 . . . . 2.08 109.851 -178.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.437 ' H ' HG22 ' A' ' 10' ' ' VAL . 36.4 m -148.29 73.29 1.24 Allowed 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.113 -1.81 . . . . 2.15 106.113 169.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 179.29 -55.97 0.09 OUTLIER Glycine 0 CA--C 1.531 1.032 0 C-N-CA 120.959 -0.639 . . . . 1.4 113.843 -166.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.6 mtp -65.26 115.99 6.14 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 117.838 0.819 . . . . 2.16 112.741 -168.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -138.01 -16.62 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.697 1.999 . . . . 1.29 113.753 -157.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.8 m -135.4 155.7 50.13 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.866 1.266 . . . . 0.76 109.42 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.01 82.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.037 -0.529 . . . . 0.42 111.003 175.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.56 68.45 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.814 -0.554 . . . . 0.26 110.065 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 81.6 m -51.12 -56.11 14.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.542 1.137 . . . . 0.47 108.734 174.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -46.59 -57.9 4.32 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.192 0.597 . . . . 0.31 111.976 173.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -50.5 -46.89 57.38 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.979 0.809 . . . . 4.74 110.701 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -63.52 -41.89 98.48 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 120.205 -0.598 . . . . 2.92 110.119 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -61.06 -51.55 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 109.289 -0.634 . . . . 0.38 109.289 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -64.19 -35.22 80.08 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 119.655 -0.818 . . . . 2.15 110.196 -176.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -62.9 -46.37 88.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.998 0.817 . . . . 2.67 111.644 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.99 -36.01 74.18 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 125.451 1.5 . . . . 0.43 110.667 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.431 HG13 HG22 ' A' ' 56' ' ' VAL . 7.1 t -82.03 -51.81 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 123.255 0.622 . . . . 2.15 110.728 175.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -61.59 -30.93 70.99 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 121.296 -0.877 . . . . 2.75 111.637 -170.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -59.91 -18.27 43.69 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.083 1.142 . . . . 0.77 114.083 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.96 -74.42 0.09 Allowed 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.941 1.246 . . . . 0.45 111.389 -173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 164.56 -63.72 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.772 2.029 . . . . 0.4 109.761 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.535 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -51.35 -46.06 52.41 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.723 1.154 . . . . 0.43 113.455 -171.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -57.54 125.02 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 124.642 1.177 . . . . 0.54 110.927 -177.449 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -97.3 -56.25 2.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.984 -1.117 . . . . 0.93 107.984 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -122.16 133.29 54.74 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 105.782 -1.933 . . . . 1.7 105.782 172.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -117.41 140.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 106.914 -1.514 . . . . 2.44 106.914 171.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -129.13 104.16 7.39 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 107.105 -1.443 . . . . 2.22 107.105 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.3 m -96.6 117.76 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.555 -1.646 . . . . 1.59 106.555 173.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.1 tp -111.13 78.15 1.09 Allowed 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 106.983 -1.488 . . . . 0.68 106.983 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -57.1 162.4 2.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.895 -1.502 . . . . 2.06 109.548 170.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.08 -53.68 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.022 1.729 . . . . 0.68 111.617 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 m -65.76 -23.07 66.65 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 122.03 -0.419 . . . . 1.14 110.013 165.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 77.13 43.37 0.12 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.323 1.049 . . . . 3.78 110.539 164.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.6 158.37 43.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.941 -0.474 . . . . 2.96 111.486 171.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.769 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -126.2 146.76 49.84 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 104.818 -2.29 . . . . 0.74 104.818 173.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.769 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.9 t -136.56 142.32 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 C-N-CA 128.722 2.809 . . . . 0.38 106.237 176.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.736 HG23 HD11 ' A' ' 44' ' ' LEU . 2.1 t -136.83 123.23 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 125.76 1.624 . . . . 0.78 107.25 -171.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -99.8 99.64 10.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.063 -2.199 . . . . 2.31 105.063 174.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -129.32 113.2 14.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.122 -1.066 . . . . 0.7 108.122 -175.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -93.96 58.05 2.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 122.302 1.049 . . . . 3.14 108.551 -173.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 172.96 -138.39 0.0 OUTLIER 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.797 -2.668 . . . . 3.63 103.797 -170.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -150.32 99.56 2.8 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 120.055 1.298 . . . . 2.53 112.152 -160.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.535 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.8 pp -146.42 2.27 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.542 0 N-CA-C 113.378 0.881 . . . . 0.53 113.378 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.415 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 0.0 OUTLIER -58.11 -47.05 84.44 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 120.414 1.461 . . . . 2.55 111.061 -170.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.09 -31.57 72.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.537 -0.465 . . . . 0.58 110.244 176.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -60.82 -48.07 83.48 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 122.033 -0.417 . . . . 2.7 110.285 171.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.717 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 37.6 t -58.59 -54.36 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.799 0.839 . . . . 0.4 110.04 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.509 ' HG3' HD13 ' A' ' 67' ' ' LEU . 24.2 tt0 -56.48 -51.82 67.02 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 124.953 1.301 . . . . 3.44 107.886 -174.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.8 t -58.5 -43.41 89.07 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.148 0.979 . . . . 0.84 111.443 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.31 -48.13 79.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.304 -0.872 . . . . 0.42 110.026 -175.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -47.9 82.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.624 0.77 . . . . 0.55 109.931 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -55.92 -45.89 78.6 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 121.155 -0.218 . . . . 1.57 110.454 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.04 -29.21 43.4 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.012 0.375 . . . . 5.5 112.012 -177.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.1 -41.1 99.3 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.795 -0.566 . . . . 0.88 109.852 172.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.62 45.75 0.09 OUTLIER Glycine 0 CA--C 1.525 0.67 0 C-N-CA 123.761 0.696 . . . . 0.77 112.297 168.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -118.58 -178.83 3.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.424 1.089 . . . . 1.97 108.906 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -145.01 65.3 1.27 Allowed 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.332 -0.855 . . . . 1.84 109.672 176.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -82.52 -178.51 7.09 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.345 0.869 . . . . 2.13 113.345 177.357 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -147.13 134.19 20.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.203 1.401 . . . . 3.26 107.286 176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 10.1 t70 -50.27 121.27 5.36 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.455 1.102 . . . . 3.59 113.074 174.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -103.81 70.61 1.02 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.711 1.205 . . . . 1.85 109.109 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.1 mp0 61.58 -179.07 0.12 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 122.513 1.149 . . . . 4.94 110.789 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -125.43 76.78 1.59 Allowed 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.648 -0.871 . . . . 2.3 108.648 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.04 87.52 0.11 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.294 1.038 . . . . 2.86 112.358 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 116.876 -1.535 . . . . 7.32 109.802 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 106.223 -1.769 . . . . 5.31 106.223 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.38 141.91 11.33 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 108.734 -1.746 . . . . 1.34 108.734 -169.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.37 127.03 27.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.787 -1.931 . . . . 1.65 105.787 173.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -97.77 147.44 24.38 Favored 'General case' 0 N--CA 1.442 -0.857 0 O-C-N 124.474 1.109 . . . . 2.56 108.044 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.656 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 29.9 m-85 -140.42 143.24 35.5 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 107.2 -1.408 . . . . 2.1 107.2 174.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 m -114.74 161.38 18.24 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.725 1.148 . . . . 1.47 112.594 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.678 ' CE3' HG11 ' A' ' 56' ' ' VAL . 15.7 m-90 -130.97 143.89 51.07 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.87 0.868 . . . . 0.38 108.669 165.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -104.96 136.66 44.03 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 105.539 -2.023 . . . . 2.13 105.539 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 11' ' ' SER . 8.6 p -124.87 -177.85 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 C-N-CA 124.178 0.991 . . . . 2.26 109.944 -172.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' HG22 ' A' ' 10' ' ' VAL . 14.5 p -135.56 40.6 2.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.508 1.123 . . . . 2.71 108.925 169.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -153.39 -130.63 1.51 Allowed Glycine 0 CA--C 1.526 0.773 0 N-CA-C 108.091 -2.003 . . . . 3.12 108.091 -177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 31.3 mtm 42.87 76.17 0.08 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.405 1.082 . . . . 2.38 112.429 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.73 -18.8 14.14 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.106 1.763 . . . . 1.95 113.616 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.5 m -133.2 156.97 46.54 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 124.077 0.951 . . . . 0.6 110.457 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.37 75.42 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.264 0.626 . . . . 0.34 111.399 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -51.32 67.76 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.684 -0.635 . . . . 0.31 109.44 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.0 m -50.57 -57.05 9.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.742 1.217 . . . . 0.47 108.825 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.24 -58.42 3.28 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.563 0.745 . . . . 0.25 110.984 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -58.75 -39.41 80.87 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.667 -0.646 . . . . 5.26 111.539 -176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -64.86 -41.43 95.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 121.707 -0.621 . . . . 2.65 110.767 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.439 HG13 HD11 ' A' ' 60' ' ' LEU . 81.8 t -62.21 -54.88 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 108.333 -0.988 . . . . 0.39 108.333 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -60.1 -41.23 92.09 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.251 -0.579 . . . . 2.54 110.763 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -58.94 -53.02 63.1 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.83 -0.544 . . . . 2.82 111.097 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.17 -33.92 69.76 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 125.165 1.386 . . . . 0.61 111.69 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG11 HG13 ' A' ' 56' ' ' VAL . 10.2 m -81.22 -42.93 20.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.296 -0.562 . . . . 1.97 110.671 170.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -54.29 -38.43 65.88 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.151 -0.968 . . . . 1.67 111.523 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -56.95 -18.3 12.94 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.411 1.263 . . . . 0.92 114.411 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 mt -58.46 -72.32 0.1 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.864 1.211 . . . . 0.53 112.122 -172.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.46 -75.85 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.116 1.766 . . . . 0.53 110.409 -178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -51.35 -39.52 43.88 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.656 1.598 . . . . 0.37 114.148 -172.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.55 120.87 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 C-N-CA 123.507 0.723 . . . . 0.48 110.932 -171.289 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -97.69 -57.46 2.23 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.762 0.825 . . . . 0.97 108.883 -171.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -119.6 152.05 37.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 105.601 -2.0 . . . . 2.14 105.601 169.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.89 146.54 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 106.615 -1.624 . . . . 2.27 106.615 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -148.05 96.91 2.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.751 -1.574 . . . . 2.54 106.751 -176.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.9 m -99.01 102.6 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 107.936 -1.135 . . . . 1.72 107.936 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.5 tp -95.31 79.59 3.5 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.67 -1.604 . . . . 0.8 106.67 -170.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -58.68 161.55 4.62 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 112.708 -2.042 . . . . 1.87 110.172 173.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.97 -53.87 0.68 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.166 1.787 . . . . 0.58 110.827 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -64.35 -15.08 59.72 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.484 0.714 . . . . 1.01 111.586 168.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 71.56 38.19 1.03 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.09 0.956 . . . . 3.35 110.737 166.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.5 156.11 41.45 Favored 'General case' 0 CA--C 1.517 -0.308 0 O-C-N 121.235 -0.916 . . . . 2.34 111.56 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.739 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -121.7 153.39 38.26 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 106.003 -1.851 . . . . 0.91 106.003 177.691 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.739 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -138.46 135.99 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 C-N-CA 130.368 3.467 . . . . 0.54 103.516 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.564 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -132.28 135.16 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 105.018 -2.215 . . . . 0.93 105.018 -176.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -110.96 103.63 12.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.701 -1.963 . . . . 2.38 105.701 173.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -137.42 106.06 5.86 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.257 1.023 . . . . 0.89 108.476 -172.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.29 58.4 2.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 122.676 1.226 . . . . 3.39 108.132 -173.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 178.37 -123.74 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 104.042 -2.577 . . . . 3.66 104.042 -173.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -162.4 108.18 1.23 Allowed 'General case' 0 C--N 1.341 0.208 0 CA-C-N 121.215 1.825 . . . . 2.37 113.936 -169.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.452 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -153.77 18.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 C-N-CA 123.746 0.818 . . . . 0.59 111.827 -171.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -70.35 -52.32 23.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.213 -1.032 . . . . 2.22 108.213 -171.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.48 -31.95 66.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.125 -0.943 . . . . 0.58 110.312 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -64.91 -50.08 67.91 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.79 -0.569 . . . . 2.93 111.261 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' CE3' ' A' ' 8' ' ' TRP . 40.0 t -53.32 -55.98 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.373 1.069 . . . . 0.44 108.849 176.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.827 ' HB2' HD21 ' A' ' 67' ' ' LEU . 6.0 pt-20 -66.74 -39.33 87.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.182 -0.437 . . . . 2.69 111.265 -173.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -52.63 -46.17 66.95 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.739 0.699 . . . . 1.31 109.755 167.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.15 -49.91 68.02 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.171 -0.307 . . . . 0.48 110.171 -173.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD22 HD13 ' A' ' 67' ' ' LEU . 4.8 mp -58.92 -44.96 91.39 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 122.854 0.461 . . . . 0.63 110.872 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -62.58 -41.61 99.05 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 122.216 -0.302 . . . . 1.47 110.26 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -62.43 -48.91 77.61 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.023 0.529 . . . . 2.78 111.193 173.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.34 78.67 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.572 0.749 . . . . 0.53 111.429 -177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.66 47.15 0.25 Allowed Glycine 0 CA--C 1.528 0.851 0 C-N-CA 124.782 1.182 . . . . 0.59 112.142 170.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -125.64 143.75 50.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.416 1.086 . . . . 1.96 109.348 176.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.2 t -102.79 67.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.996 1.318 . . . . 2.21 108.83 -174.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -80.51 168.14 19.28 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.674 0.99 . . . . 1.83 113.674 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -140.76 145.8 36.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.44 0.696 . . . . 3.27 109.756 169.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 18.9 t0 -67.85 117.66 10.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 127.213 2.205 . . . . 3.58 112.714 -168.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.76 61.45 1.67 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.997 1.379 . . . . 2.53 110.511 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.6 152.91 44.37 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 120.462 -1.399 . . . . 7.45 110.835 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -165.83 -54.06 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.351 1.061 . . . . 5.68 108.822 -179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 69.81 -70.68 0.14 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.038 1.335 . . . . 4.65 111.462 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 C--O 1.247 0.923 0 N-CA-C 108.046 -1.094 . . . . 8.58 108.046 158.229 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 120.595 0.236 . . . . 4.72 110.429 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.11 -176.58 41.43 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 109.873 -1.291 . . . . 1.35 109.873 166.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -125.93 118.02 24.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.542 1.537 . . . . 1.36 107.853 -177.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -96.88 133.05 42.01 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.765 -1.198 . . . . 2.64 107.765 173.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.906 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 94.9 m-85 -121.71 164.9 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 126.033 1.733 . . . . 2.51 109.264 170.388 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -149.71 150.72 32.52 Favored 'General case' 0 N--CA 1.46 0.067 0 O-C-N 121.579 -0.701 . . . . 1.95 111.755 -179.209 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.906 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 16.7 m-90 -134.95 143.36 46.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.883 1.273 . . . . 0.28 108.642 175.406 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.54 142.33 29.5 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 106.357 -1.72 . . . . 2.16 106.357 169.822 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.484 HG21 ' HE3' ' A' ' 13' ' ' MET . 12.1 p -140.2 108.37 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 113.754 1.02 . . . . 1.83 113.754 -171.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -75.63 72.97 2.62 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.478 -0.564 . . . . 2.17 109.478 175.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.6 -56.22 0.04 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.399 0.52 . . . . 1.43 114.399 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.491 ' CE ' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt -64.36 119.76 10.94 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.016 0.908 . . . . 3.01 112.896 -163.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -126.83 -22.38 3.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.539 2.336 . . . . 1.18 113.154 -162.036 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -131.69 153.78 49.66 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.121 1.368 . . . . 0.66 110.111 -173.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.65 -38.11 89.01 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.132 -0.486 . . . . 0.38 110.852 173.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.74 -52.91 63.51 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.828 -0.434 . . . . 0.34 109.828 176.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.7 m -52.41 -54.11 36.31 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.919 1.288 . . . . 0.49 108.756 175.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.75 -50.07 45.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.524 0.73 . . . . 0.34 111.998 176.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -41.56 99.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.942 -0.474 . . . . 4.63 110.801 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.04 -44.84 96.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.787 -0.82 . . . . 4.07 108.787 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG11 ' CE ' ' A' ' 13' ' ' MET . 69.9 t -61.37 -56.18 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.522 0.729 . . . . 0.38 109.045 178.863 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -55.94 -39.99 72.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.846 -0.798 . . . . 1.9 108.846 -173.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.23 -53.11 59.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.087 0.555 . . . . 2.72 109.927 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.04 -32.23 61.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.47 112.153 -178.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 56' ' ' VAL . 13.0 m -85.9 -41.32 15.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.386 0.539 . . . . 1.87 111.536 172.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -57.95 -34.3 69.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.996 -1.065 . . . . 2.01 111.052 -175.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -58.48 -17.19 19.04 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.214 1.19 . . . . 0.88 114.214 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 86.8 mt -60.7 -71.12 0.15 Allowed 'General case' 0 C--N 1.343 0.315 0 CA-C-N 120.138 1.335 . . . . 0.44 112.115 -169.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 161.84 -72.28 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.082 2.153 . . . . 0.36 110.645 -178.15 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.44 -36.55 7.84 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 126.459 1.98 . . . . 0.35 114.455 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.421 HG12 ' H ' ' A' ' 32' ' ' VAL . 1.3 p -73.36 126.12 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 C-N-CA 124.425 1.09 . . . . 0.35 112.117 -169.486 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -103.11 -58.16 1.92 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.517 1.127 . . . . 1.01 109.649 -175.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -119.68 118.15 30.15 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 106.682 -1.599 . . . . 2.06 106.682 175.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -101.05 144.15 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.068 -1.086 . . . . 2.14 108.068 174.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -143.37 100.01 3.54 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.724 -0.843 . . . . 1.74 108.724 175.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.3 t -97.9 111.51 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 107.761 -1.2 . . . . 2.39 107.761 177.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.7 tp -106.1 82.89 1.82 Allowed 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.271 -1.381 . . . . 0.5 107.271 176.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -60.15 171.76 0.94 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.585 -1.189 . . . . 1.86 110.59 171.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.37 -61.57 0.46 Allowed 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 125.352 1.461 . . . . 0.58 109.82 -176.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.1 m -79.8 49.19 1.02 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.796 0.838 . . . . 1.19 109.177 169.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 8.12 48.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 131.26 3.824 . . . . 4.36 118.555 178.653 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.68 159.39 42.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 120.591 1.541 . . . . 3.22 114.209 174.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -133.61 142.32 48.05 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 104.916 -2.253 . . . . 0.64 104.916 174.495 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.687 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.2 t -128.4 135.36 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 128.958 2.903 . . . . 0.44 103.666 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.593 HG23 HD11 ' A' ' 44' ' ' LEU . 1.4 t -130.26 128.67 64.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 106.537 -1.653 . . . . 0.86 106.537 -178.285 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -107.2 107.16 17.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 103.74 -2.689 . . . . 2.13 103.74 172.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -141.6 113.1 7.64 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.013 0.525 . . . . 1.05 110.095 -167.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -107.77 57.58 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.789 -1.189 . . . . 2.57 107.789 -165.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -149.72 -80.67 0.12 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 105.617 -1.994 . . . . 2.48 105.617 170.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.0 t0 159.34 106.92 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 130.003 3.321 . . . . 2.16 105.33 -178.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.414 HD11 HG11 ' A' ' 46' ' ' VAL . 2.8 pp -142.85 -10.15 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 117.845 -1.074 . . . . 0.48 113.473 176.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 4.0 ptt85 -45.9 -42.58 12.83 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 121.514 1.961 . . . . 2.85 112.64 179.112 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.28 80.95 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.479 0.656 . . . . 0.63 110.91 177.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.49 -43.55 89.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.698 -0.626 . . . . 3.07 111.721 167.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.673 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 83.3 t -58.54 -54.95 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 118.967 0.803 . . . . 0.33 110.137 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.11 -47.38 85.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.627 0.371 . . . . 3.15 110.084 -177.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 t -52.37 -44.18 65.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.227 0.211 . . . . 0.99 110.94 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.6 -49.76 56.8 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.399 0.68 . . . . 0.3 110.454 -172.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.679 HD22 HD23 ' A' ' 67' ' ' LEU . 7.0 mp -59.42 -46.26 89.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.054 0.942 . . . . 0.45 110.116 175.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -59.16 -46.01 89.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.175 -0.306 . . . . 1.55 110.175 178.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -65.64 -39.52 91.51 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.986 0.914 . . . . 3.79 111.571 178.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.58 95.2 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.265 1.026 . . . . 0.77 110.376 177.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 131.12 48.71 0.11 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.327 0.965 . . . . 0.55 112.095 171.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -123.05 172.91 8.18 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.435 1.094 . . . . 1.87 109.869 173.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.7 m -135.59 76.52 1.62 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.475 1.11 . . . . 1.6 108.726 178.456 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.679 HD23 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -84.11 179.51 7.48 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.923 0.868 . . . . 2.13 113.112 174.28 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -149.31 142.19 24.72 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.45 -1.315 . . . . 4.56 107.45 166.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -49.21 137.99 13.07 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.247 1.419 . . . . 2.72 111.552 171.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -125.41 59.35 1.26 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.71 1.204 . . . . 2.63 110.009 166.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 64.01 168.58 0.16 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.947 1.699 . . . . 4.81 113.449 173.216 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.36 71.67 1.38 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.127 -1.397 . . . . 1.9 108.838 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 64.99 102.21 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.031 0.932 . . . . 2.56 113.353 -176.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 . . . . . 0 C--O 1.257 1.449 0 CA-C-O 116.464 -1.731 . . . . 7.72 106.452 138.312 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 105.825 -1.917 . . . . 5.44 105.825 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -151.89 -87.24 0.06 OUTLIER Glycine 0 CA--C 1.522 0.519 0 N-CA-C 109.067 -1.613 . . . . 1.55 109.067 -176.874 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.0 m -144.35 150.82 38.41 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 105.974 -1.862 . . . . 1.25 105.974 161.046 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -104.28 121.91 44.31 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.076 -1.453 . . . . 3.54 107.076 166.711 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.882 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 10.4 m-85 -107.73 150.26 27.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 118.05 -0.976 . . . . 2.24 109.554 165.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.0 t -141.8 155.17 45.59 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.188 0.904 . . . . 1.65 111.538 172.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.882 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 3.6 m-90 -140.11 154.58 47.06 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.683 1.193 . . . . 0.58 108.847 169.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -97.39 115.19 27.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.4 1.08 . . . . 1.96 108.129 177.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.23 166.13 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.785 0.834 . . . . 3.06 109.69 -175.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 t -130.74 -29.05 1.96 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.111 1.152 . . . . 2.4 114.111 -176.387 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.22 11.34 50.19 Favored Glycine 0 CA--C 1.544 1.863 0 O-C-N 121.054 -1.029 . . . . 2.01 113.309 179.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.52 107.93 18.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.512 1.525 . . . . 7.49 109.197 -173.107 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -156.28 10.88 0.26 Allowed 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.266 -0.896 . . . . 1.81 110.971 -173.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB2' ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -153.36 128.26 9.57 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.577 -1.268 . . . . 1.99 107.577 -161.068 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.13 -25.86 67.28 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.608 -1.307 . . . . 0.85 110.645 173.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -33.6 74.47 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.774 -0.632 . . . . 0.83 111.395 170.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 89.2 m -65.37 -51.89 57.37 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.023 -1.473 . . . . 1.36 107.023 173.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.74 -56.95 4.67 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.599 0.238 . . . . 0.52 110.932 176.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.97 -47.23 85.78 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 111.981 0.363 . . . . 6.31 111.981 -179.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.0 mttp -58.79 -44.32 90.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.308 -0.87 . . . . 3.33 110.094 -179.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.36 -52.31 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 108.598 -0.89 . . . . 0.53 108.598 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.15 -34.82 78.44 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 119.914 -0.714 . . . . 1.84 109.56 -174.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -67.34 -48.3 67.94 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.324 0.65 . . . . 2.79 110.972 174.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.25 64.24 Favored 'General case' 0 N--CA 1.461 0.079 0 C-N-CA 125.042 1.337 . . . . 0.52 110.552 178.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 56' ' ' VAL . 85.5 t -77.54 -56.01 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 122.787 0.435 . . . . 2.15 111.139 175.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -56.52 -36.68 69.49 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 123.488 0.715 . . . . 1.73 111.12 -169.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.65 -17.77 49.41 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.038 1.125 . . . . 0.88 114.038 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.6 mt -60.28 -71.04 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.543 1.065 . . . . 0.64 112.121 -170.086 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.96 -65.33 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.338 2.255 . . . . 0.58 109.8 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.539 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -41.41 -51.01 4.6 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 126.129 1.823 . . . . 0.56 114.33 -177.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -64.31 130.21 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 124.926 1.29 . . . . 0.35 111.269 -170.226 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -92.21 -55.36 3.45 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.143 -1.428 . . . . 1.18 107.143 174.23 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -127.41 132.57 50.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.29 -1.004 . . . . 2.62 108.29 -174.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.96 144.92 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 125.51 1.524 . . . . 2.24 108.069 173.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -142.17 87.6 2.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.966 -1.494 . . . . 1.84 106.966 169.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 85.6 t -98.75 102.51 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 108.358 -0.978 . . . . 2.21 108.358 -178.69 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.4 tp -99.22 84.34 3.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.857 -1.164 . . . . 0.5 107.857 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -62.83 169.87 2.96 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 114.717 -1.129 . . . . 1.85 110.031 170.707 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 67.21 -59.68 0.39 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.152 1.381 . . . . 0.66 110.473 -170.368 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.82 22.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.514 1.126 . . . . 1.18 113.019 175.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 61.63 24.87 14.9 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.521 1.304 . . . . 3.67 114.521 159.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 149.35 29.62 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.624 1.713 . . . . 2.61 115.624 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.7 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -121.74 139.72 53.22 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 105.629 -1.989 . . . . 0.72 105.629 177.573 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.7 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -126.8 141.95 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 128.001 2.52 . . . . 0.43 106.58 171.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 55.5 t -129.17 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 124.333 1.053 . . . . 0.71 108.401 171.333 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.8 103.29 11.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.541 -1.652 . . . . 1.95 106.541 172.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.75 142.64 49.99 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.77 1.628 . . . . 0.75 108.291 -178.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.18 57.97 0.64 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.352 1.073 . . . . 2.3 109.539 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -178.4 -116.09 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 102.98 -2.97 . . . . 3.09 102.98 179.484 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 52' ' ' ILE . 18.4 t0 -168.75 135.83 1.92 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 120.276 1.398 . . . . 2.47 111.457 171.674 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.539 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.4 pp -158.35 10.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-O 117.827 -1.082 . . . . 0.52 112.675 -174.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -63.83 -42.87 97.53 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 122.01 2.186 . . . . 2.08 110.273 -169.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.16 -43.59 64.16 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.49 109.781 172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -51.42 69.33 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.16 1.384 . . . . 3.11 111.245 172.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.688 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 72.0 t -57.27 -49.6 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 N-CA-C 108.643 -0.873 . . . . 0.4 108.643 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.468 ' HA ' HD21 ' A' ' 67' ' ' LEU 0.305 10.8 pt-20 -72.84 -40.58 65.61 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 109.045 -0.724 . . . . 2.86 109.045 -166.584 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.4 m -49.48 -46.67 48.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.236 0.615 . . . . 1.86 111.991 161.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.01 -51.98 58.66 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 121.674 -0.641 . . . . 0.33 110.329 -174.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.811 HD22 HD13 ' A' ' 67' ' ' LEU . 5.5 mp -59.03 -44.34 91.72 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.896 0.878 . . . . 0.46 110.912 176.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -58.96 -43.7 91.34 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 110.013 -0.366 . . . . 1.5 110.013 178.005 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -65.37 -41.4 93.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 111.874 0.324 . . . . 3.59 111.874 175.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.01 -33.88 77.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.604 0.761 . . . . 0.55 111.37 178.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.56 43.73 0.45 Allowed Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.882 1.23 . . . . 0.55 112.199 172.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -121.81 172.11 8.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.855 1.262 . . . . 2.0 109.061 173.17 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 30.8 m -134.88 73.1 1.47 Allowed 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.601 0.761 . . . . 1.54 109.328 -176.003 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.811 HD13 HD22 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -84.42 169.84 14.16 Favored 'General case' 0 CA--C 1.523 -0.09 0 N-CA-C 113.212 0.819 . . . . 1.77 113.212 176.783 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -153.5 140.08 18.83 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.028 -1.101 . . . . 6.37 108.028 173.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -44.31 132.15 5.98 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 126.95 2.1 . . . . 2.74 112.615 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -120.42 57.76 0.94 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.383 1.073 . . . . 1.93 109.547 165.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 64.73 -178.58 0.17 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 126.81 2.044 . . . . 3.96 112.352 162.133 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -101.8 68.7 1.16 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.152 -1.425 . . . . 2.15 107.152 -167.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.89 -63.05 0.44 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.725 0.81 . . . . 3.0 110.394 -167.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 C--O 1.25 1.08 0 N-CA-C 106.611 -1.626 . . . . 7.09 106.611 164.025 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 110.659 -0.126 . . . . 6.42 110.659 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.75 -95.72 0.05 OUTLIER Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.968 -0.853 . . . . 1.38 110.968 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.1 m -144.13 126.51 15.8 Favored 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 121.168 -1.195 . . . . 1.07 109.638 165.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.6 127.11 40.32 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.982 1.372 . . . . 3.13 108.614 169.203 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.82 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 22.1 m-85 -105.65 165.77 10.93 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.771 2.428 . . . . 1.87 109.714 169.57 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.7 t -145.94 152.37 39.31 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.95 0.9 . . . . 1.53 111.233 177.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.82 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 22.6 m-90 -140.79 138.72 34.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.386 1.474 . . . . 0.4 109.763 175.745 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -101.56 134.79 44.13 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 127.186 2.194 . . . . 1.65 106.852 174.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG11 ' SD ' ' A' ' 13' ' ' MET . 7.1 p -141.1 101.71 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 123.988 0.805 . . . . 1.94 112.02 -161.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.6 t -71.41 82.72 0.79 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.672 -0.862 . . . . 1.87 108.672 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.96 -44.31 0.12 Allowed Glycine 0 CA--C 1.53 1.024 0 CA-C-O 119.518 -0.601 . . . . 1.31 114.501 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.425 ' SD ' HG11 ' A' ' 10' ' ' VAL . 85.1 mtp -67.66 113.72 5.69 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.502 1.151 . . . . 2.47 112.643 -166.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -125.97 -35.71 2.44 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.156 2.182 . . . . 1.42 113.25 -158.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.5 m -125.92 157.88 36.6 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 126.207 1.803 . . . . 0.62 110.554 -171.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.75 71.67 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.152 -0.476 . . . . 0.41 111.11 173.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.46 -51.85 65.86 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.641 -0.662 . . . . 0.31 109.786 175.676 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -50.23 -54.04 23.86 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.256 1.423 . . . . 0.44 108.474 173.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.55 -48.8 65.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.413 0.685 . . . . 0.33 112.793 175.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -57.08 -42.94 81.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.438 1.017 . . . . 4.13 110.93 176.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -63.36 -39.84 95.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.398 -0.921 . . . . 3.08 109.201 178.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.57 -51.79 58.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 118.843 -0.599 . . . . 0.43 109.832 -179.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -56.31 -37.65 70.22 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.435 -0.906 . . . . 2.6 110.267 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -63.07 -51.85 65.03 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.203 0.525 . . . . 2.96 110.566 178.16 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.45 -38.12 76.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.415 1.486 . . . . 0.45 111.096 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.431 ' CG1' HG13 ' A' ' 56' ' ' VAL . 9.0 m -81.88 -48.17 18.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 121.123 -0.231 . . . . 1.73 110.945 174.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -58.26 -33.62 69.59 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.87 -1.144 . . . . 1.79 111.823 -170.186 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -61.5 -16.76 50.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.238 1.199 . . . . 0.7 114.238 178.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 40.5 mt -61.21 -73.83 0.09 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.397 0.998 . . . . 0.49 112.359 -170.249 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.77 -74.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.827 2.051 . . . . 0.5 110.789 -176.345 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -45.52 -39.31 7.69 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 126.452 1.977 . . . . 0.44 114.01 -175.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.51 123.81 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 C-N-CA 125.387 1.475 . . . . 0.48 111.535 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -103.44 -52.54 2.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.176 1.39 . . . . 1.07 110.082 -174.497 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -121.85 139.47 53.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.802 -1.555 . . . . 1.85 106.802 175.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.05 146.22 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 107.293 -1.373 . . . . 2.58 107.293 176.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -139.62 91.62 2.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.212 -1.033 . . . . 1.66 108.212 173.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.7 m -94.13 113.2 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.414 -1.328 . . . . 1.81 107.414 176.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 30.9 tp -117.95 77.89 1.19 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.291 -1.374 . . . . 0.63 107.291 176.302 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -52.99 161.2 0.83 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 113.62 -1.627 . . . . 1.83 109.844 170.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 68.8 -16.73 0.21 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.966 1.306 . . . . 1.34 113.947 -178.673 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.9 p -108.53 14.83 24.32 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.784 0.833 . . . . 2.32 110.543 164.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 37.14 57.19 1.27 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 126.244 1.817 . . . . 4.25 112.752 -177.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.58 148.97 30.76 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 123.049 1.404 . . . . 3.07 112.628 161.439 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD12 ' H ' ' A' ' 45' ' ' VAL . 3.2 tp -118.91 149.51 41.45 Favored 'General case' 0 N--CA 1.419 -2.015 0 C-N-CA 128.822 2.849 . . . . 0.76 103.609 168.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.52 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -140.5 138.33 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 C-N-CA 130.472 3.509 . . . . 0.33 103.775 176.512 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.499 HG23 HD11 ' A' ' 44' ' ' LEU . 2.9 t -132.72 122.48 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 106.971 -1.492 . . . . 0.6 106.971 -177.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.45 113.48 25.87 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 105.417 -2.068 . . . . 2.12 105.417 174.278 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -136.74 144.12 43.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.051 0.844 . . . . 0.81 110.483 -169.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -123.8 59.09 1.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 O-C-N 123.976 0.798 . . . . 2.36 108.917 -177.459 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -164.91 -57.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.217 1.007 . . . . 2.63 109.169 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 60.8 t0 120.04 118.7 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 131.467 3.907 . . . . 2.11 107.358 -172.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.465 HD13 HG23 ' A' ' 56' ' ' VAL . 1.9 pp -143.5 17.58 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 125.085 1.354 . . . . 0.42 108.672 173.133 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.47 -49.74 70.23 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 117.219 -1.792 . . . . 2.88 108.746 -164.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.47 -38.27 63.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.63 110.556 175.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -50.64 72.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.448 0.699 . . . . 3.17 111.178 171.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.752 HG11 ' HZ3' ' A' ' 8' ' ' TRP . 64.0 t -58.44 -57.96 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 C-N-CA 123.909 0.884 . . . . 0.38 110.09 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -57.02 -44.79 83.19 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.702 -0.19 . . . . 3.65 110.999 -178.944 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.3 t -52.03 -50.15 61.98 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.593 -0.521 . . . . 1.06 109.593 170.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.28 -50.49 72.79 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 121.803 -0.56 . . . . 0.39 110.518 -172.512 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.685 HD22 HD13 ' A' ' 67' ' ' LEU . 7.1 mp -53.75 -46.57 70.95 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.816 0.846 . . . . 0.46 110.322 173.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -64.24 -41.16 97.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.901 -0.499 . . . . 1.47 111.466 -178.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.86 -47.57 84.44 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 109.713 -0.477 . . . . 2.76 109.713 173.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.89 -36.28 74.4 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.116 0.566 . . . . 0.49 111.012 179.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.5 35.79 0.68 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.54 1.067 . . . . 0.61 112.224 168.263 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -105.46 163.94 12.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.923 0.889 . . . . 1.93 110.292 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 11.4 t -122.01 79.16 1.55 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.132 -1.433 . . . . 2.12 107.132 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.685 HD13 HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -84.2 170.62 13.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.763 1.023 . . . . 1.77 113.763 172.764 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -151.33 147.95 27.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 107.934 -1.136 . . . . 3.45 107.934 163.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -50.64 139.8 15.54 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.945 1.698 . . . . 2.75 111.967 175.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 -123.49 57.24 1.17 Allowed 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.25 1.42 . . . . 2.35 108.948 167.089 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 60.46 -178.8 0.1 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 122.881 1.324 . . . . 4.33 111.532 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -122.65 120.27 33.21 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 102.654 -3.091 . . . . 1.87 102.654 174.445 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -46.09 76.34 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.455 -0.498 . . . . 3.49 110.27 -178.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.669 1.187 . . . . 10.61 110.302 -175.664 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.23 0.075 0 N-CA-C 110.164 -0.31 . . . . 5.76 110.164 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.67 -167.3 22.33 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.718 -0.953 . . . . 2.09 110.718 173.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.5 m -96.16 115.06 26.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 106.277 -1.749 . . . . 1.43 106.277 173.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.28 131.17 40.16 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 106.429 -1.693 . . . . 2.83 106.429 169.218 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.772 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 73.8 m-85 -110.55 164.54 12.61 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.563 1.545 . . . . 2.08 107.822 170.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 t -141.51 152.13 43.89 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.12 0.568 . . . . 1.68 110.664 177.162 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.772 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 8.4 m-90 -132.73 145.48 51.06 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.973 1.309 . . . . 0.47 109.665 171.628 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -107.11 126.25 52.13 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.951 -1.5 . . . . 2.09 106.951 174.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.559 HG22 ' H ' ' A' ' 11' ' ' SER . 10.5 p -123.07 -178.88 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.749 1.22 . . . . 1.7 109.559 -168.021 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.559 ' H ' HG22 ' A' ' 10' ' ' VAL . 3.9 p -153.05 72.01 0.93 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.076 -1.083 . . . . 2.8 108.076 -175.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.85 -26.66 0.12 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 114.373 0.509 . . . . 1.62 114.373 -176.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.6 mtm -73.57 84.2 1.54 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 120.972 -1.31 . . . . 2.07 110.725 177.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -103.21 -7.25 21.34 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 115.156 1.539 . . . . 1.41 115.156 -176.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -135.44 148.7 49.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.599 1.09 . . . . 0.68 109.338 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -33.81 76.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.511 0.196 . . . . 0.37 111.002 175.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.69 70.47 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.731 -0.606 . . . . 0.3 110.089 176.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.16 -53.66 40.27 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.04 0.936 . . . . 0.48 108.6 173.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.52 -52.07 24.32 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.482 0.713 . . . . 0.26 111.105 176.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -42.12 99.17 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.361 0.528 . . . . 3.97 111.585 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -63.76 -41.24 98.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.46 -0.57 . . . . 2.9 109.46 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 60' ' ' LEU . 76.4 t -66.78 -56.02 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 123.303 0.641 . . . . 0.64 109.629 178.684 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.27 -41.41 62.84 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.959 -0.756 . . . . 1.77 108.959 -177.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -65.6 -54.18 31.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 117.57 0.168 . . . . 2.63 110.808 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.51 -36.39 66.63 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.212 1.005 . . . . 0.78 111.986 -177.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 m -80.57 -47.54 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 109.111 -0.7 . . . . 2.16 109.111 175.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -52.74 -41.76 64.31 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 120.689 -1.257 . . . . 1.86 112.07 -177.802 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -59.94 -16.83 33.04 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.124 1.157 . . . . 1.13 114.124 -179.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 43.6 mt -52.22 -65.97 0.47 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.646 1.112 . . . . 0.47 112.186 -170.734 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 158.75 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 128.234 2.613 . . . . 0.51 109.317 176.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -43.81 -48.23 7.61 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 126.021 1.772 . . . . 0.51 113.849 -176.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -62.23 128.79 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 124.328 1.051 . . . . 0.51 111.94 -165.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -93.18 -52.57 4.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.306 -1.368 . . . . 1.5 107.306 -176.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -135.17 145.93 48.23 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.052 -1.462 . . . . 1.84 107.052 178.431 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -123.39 136.25 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 107.523 -1.288 . . . . 1.9 107.523 -177.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -144.85 88.09 1.88 Allowed 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.124 -1.065 . . . . 1.78 108.124 -178.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -97.9 108.25 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 108.972 -0.751 . . . . 1.74 108.972 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 32.6 tp -99.92 78.74 2.14 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.004 -1.48 . . . . 0.54 107.004 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -54.75 162.38 1.24 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.678 -1.601 . . . . 1.9 110.117 171.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.73 -37.38 0.39 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.846 1.658 . . . . 0.67 112.604 -179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.0 m -89.31 22.38 2.91 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.41 1.084 . . . . 0.94 110.287 165.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 32.44 49.8 0.16 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.261 2.224 . . . . 4.82 115.357 176.458 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.78 150.01 35.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.701 0.763 . . . . 2.96 111.778 165.534 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.581 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -123.1 135.97 54.6 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 105.774 -1.936 . . . . 0.62 105.774 169.984 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.581 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.1 t -118.75 138.4 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 N-CA-C 106.192 -1.781 . . . . 0.3 106.192 172.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.561 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -130.98 128.05 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 106.464 -1.68 . . . . 0.73 106.464 -177.151 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -97.72 120.05 37.41 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.496 -1.668 . . . . 3.89 106.496 171.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.5 128.03 7.86 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.183 0.302 . . . . 0.93 110.235 -176.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -115.81 57.56 0.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.341 1.067 . . . . 2.72 109.457 -170.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.28 -97.95 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.862 -2.644 . . . . 3.4 103.862 178.499 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -172.64 109.81 0.21 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.209 -0.663 . . . . 2.24 109.209 166.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.8 pp -138.06 -16.13 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 CA-C-O 116.837 -1.554 . . . . 0.54 114.309 172.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -37.8 -48.46 1.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 122.103 2.228 . . . . 2.93 113.774 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.71 -36.38 82.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.562 0.696 . . . . 0.62 110.817 178.179 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.05 -47.95 84.01 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.158 1.383 . . . . 3.05 111.854 167.073 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.752 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 93.0 t -57.46 -50.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 123.82 0.848 . . . . 0.38 108.87 -179.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.898 ' HB2' HD21 ' A' ' 67' ' ' LEU . 21.0 pt-20 -71.11 -43.83 66.88 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.112 -0.699 . . . . 2.71 109.112 -169.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.5 m -47.62 -48.81 28.4 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.941 -0.572 . . . . 2.13 111.627 163.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.0 58.36 Favored 'General case' 0 C--N 1.335 -0.053 0 O-C-N 121.777 -0.577 . . . . 0.46 110.334 -173.17 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 22' ' ' VAL . 7.6 mp -55.01 -47.1 75.12 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.216 1.406 . . . . 0.51 110.527 175.26 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -58.03 -47.73 82.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 110.064 -0.347 . . . . 1.57 110.064 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -39.54 94.11 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.345 0.498 . . . . 3.94 112.345 178.034 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.38 90.95 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.522 0.729 . . . . 0.71 110.399 177.213 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.38 45.67 0.24 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.565 1.078 . . . . 0.54 111.746 170.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -120.69 160.78 22.61 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.414 1.085 . . . . 1.76 109.9 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -120.81 77.67 1.31 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.954 1.302 . . . . 1.38 107.838 -179.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -83.24 165.92 19.0 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 115.191 -0.913 . . . . 1.9 112.646 172.497 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 18.6 ttp85 -146.57 147.72 31.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.548 -0.538 . . . . 4.58 109.548 157.684 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -43.68 132.09 5.07 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.821 2.048 . . . . 2.88 112.375 173.252 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -116.18 54.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.53 1.532 . . . . 2.19 108.194 163.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 58.15 172.39 0.06 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.661 1.985 . . . . 3.87 113.664 174.456 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.68 73.02 1.58 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.252 -1.018 . . . . 1.96 108.252 178.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 58.17 83.24 0.12 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.738 1.384 . . . . 2.79 114.738 -177.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 107.481 -1.303 . . . . 7.39 107.481 130.715 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.451 -0.38 0 CA-C-O 119.12 -0.467 . . . . 4.76 110.581 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.83 144.69 45.6 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.824 -0.91 . . . . 1.84 110.824 178.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.62 108.14 20.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.434 -1.321 . . . . 1.06 107.434 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.04 128.26 37.81 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 105.983 -1.858 . . . . 2.65 105.983 175.051 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.745 ' CB ' ' HZ2' ' A' ' 8' ' ' TRP . 43.0 m-85 -114.73 165.6 12.63 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.979 1.312 . . . . 2.01 108.501 170.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.86 148.31 31.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.781 0.832 . . . . 2.33 110.622 -172.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.745 ' HZ2' ' CB ' ' A' ' 6' ' ' TYR . 12.2 m-90 -135.98 143.52 44.88 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.113 0.965 . . . . 0.51 110.821 174.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -100.05 113.88 26.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 125.243 1.417 . . . . 1.7 108.002 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.8 m -98.56 -176.64 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 O-C-N 123.544 0.528 . . . . 2.56 109.666 -178.438 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 t -158.48 87.68 0.9 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 104.963 -2.236 . . . . 1.84 104.963 170.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.58 -36.09 0.63 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.879 -0.677 . . . . 1.46 114.247 -173.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.1 mtp -70.71 98.46 1.53 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.589 1.194 . . . . 2.25 109.798 -176.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 p-10 -117.68 -18.69 9.6 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.617 2.367 . . . . 1.2 113.886 -160.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.06 150.82 49.78 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.79 1.236 . . . . 0.65 109.354 -175.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.7 71.72 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.649 -0.25 . . . . 0.4 111.052 173.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.19 -51.01 68.06 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.489 -0.757 . . . . 0.28 110.152 175.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.5 m -54.04 -53.22 56.08 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.657 1.183 . . . . 0.52 108.214 175.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.8 -53.13 16.38 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 123.999 0.92 . . . . 0.29 111.451 174.464 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -57.43 -46.28 83.75 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.806 -0.559 . . . . 4.84 110.647 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -62.24 -41.31 98.31 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 119.521 -0.871 . . . . 2.81 109.453 -177.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 60' ' ' LEU . 88.7 t -63.72 -49.9 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 122.933 0.493 . . . . 0.61 110.106 178.377 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -62.25 -40.52 96.44 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.467 -0.938 . . . . 1.84 108.467 -173.608 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -64.35 -46.49 83.24 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.807 0.843 . . . . 2.96 109.299 177.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.8 85.48 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 124.528 1.131 . . . . 0.82 112.133 179.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.8 m -77.05 -44.97 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 118.337 0.517 . . . . 1.76 110.525 175.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -54.1 -41.98 68.89 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 122.917 0.487 . . . . 1.84 110.944 -172.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -61.48 -15.23 35.72 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.717 1.377 . . . . 1.66 114.717 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 77.8 mt -57.15 -69.41 0.16 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 120.267 1.394 . . . . 0.53 111.647 -173.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 160.72 -68.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 127.75 2.42 . . . . 0.52 110.607 177.606 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -42.34 -40.87 3.75 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 126.805 2.145 . . . . 0.45 114.442 -177.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.82 125.57 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 C-N-CA 124.871 1.268 . . . . 0.56 111.215 -174.254 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -94.68 -56.31 2.83 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 106.943 -1.503 . . . . 1.61 106.943 178.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -125.48 126.67 45.28 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.754 -1.573 . . . . 2.37 106.754 -177.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.0 p -100.44 143.86 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 108.067 -1.086 . . . . 1.84 108.067 177.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -149.38 84.8 1.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.497 0.59 . . . . 2.01 109.486 176.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.741 HG12 HD13 ' A' ' 44' ' ' LEU . 2.2 m -93.8 105.66 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 123.293 0.637 . . . . 1.74 109.44 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.3 tp -97.91 82.5 3.01 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.038 -1.467 . . . . 0.5 107.038 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -59.3 163.43 3.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.426 -1.716 . . . . 1.9 109.788 170.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 72.06 -41.49 0.51 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.396 1.878 . . . . 0.6 112.242 179.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.53 14.97 10.18 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.274 1.029 . . . . 0.95 110.179 163.386 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.15 33.98 7.87 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 116.793 2.145 . . . . 4.83 116.793 165.115 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.5 120.83 13.98 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.542 -0.91 . . . . 4.1 108.542 -174.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.922 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -106.86 140.36 39.82 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.228 -1.768 . . . . 0.73 106.228 170.278 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.0 t -122.04 136.17 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 127.577 2.351 . . . . 0.46 106.814 170.159 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.922 HG23 HD11 ' A' ' 44' ' ' LEU . 1.3 t -128.01 120.81 54.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 126.052 1.741 . . . . 0.7 106.403 -178.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.7 95.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 105.867 -1.901 . . . . 2.63 105.867 178.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.47 122.95 25.69 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 124.116 0.966 . . . . 1.03 110.961 -164.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -115.31 57.66 0.73 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 122.904 1.335 . . . . 2.84 109.378 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -140.0 -104.82 0.16 Allowed 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 103.293 -2.854 . . . . 2.77 103.293 153.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -162.68 29.58 0.1 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.365 1.078 . . . . 2.44 111.284 179.105 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.41 HD11 HG11 ' A' ' 46' ' ' VAL . 2.7 pp -65.32 -17.56 22.23 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.756 0 O-C-N 121.05 -1.031 . . . . 0.83 113.16 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -45.05 -39.73 6.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 120.769 1.622 . . . . 2.15 113.987 -177.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.46 77.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.746 0.703 . . . . 0.61 109.699 177.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -59.38 -42.14 90.99 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 118.913 -0.565 . . . . 3.01 111.62 167.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.688 ' HB ' ' HZ3' ' A' ' 8' ' ' TRP . 62.4 t -63.32 -50.59 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 118.784 0.72 . . . . 0.73 109.12 178.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.615 ' HA ' HD21 ' A' ' 67' ' ' LEU . 17.6 tt0 -55.98 -52.39 64.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.54 -0.911 . . . . 3.49 108.54 -178.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -56.83 -47.81 79.48 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.797 -0.564 . . . . 1.03 111.506 174.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.2 -48.46 73.29 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.202 1.001 . . . . 0.7 110.601 -171.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.507 HD11 HG13 ' A' ' 22' ' ' VAL . 4.0 mp -62.79 -45.92 90.42 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.132 0.573 . . . . 0.56 109.621 175.541 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.0 -41.16 77.94 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 120.188 -0.605 . . . . 2.02 110.864 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -67.77 -45.89 73.58 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.68 0.792 . . . . 3.59 112.091 175.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.27 71.06 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.304 1.042 . . . . 0.9 110.184 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 124.45 37.39 0.56 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.082 0.849 . . . . 0.66 111.519 165.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -109.28 171.93 7.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 123.873 0.869 . . . . 2.29 108.805 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.9 m -121.88 60.83 0.96 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.624 -0.88 . . . . 1.68 108.624 -175.329 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.615 HD21 ' HA ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER -81.11 160.84 24.33 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.821 -0.627 . . . . 1.71 112.197 176.524 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -155.21 142.89 19.79 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 107.031 -1.47 . . . . 6.64 107.031 168.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.05 112.1 1.25 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.551 1.315 . . . . 3.67 114.551 -176.231 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -85.68 62.53 7.52 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.444 1.498 . . . . 1.93 109.926 168.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 69.73 143.54 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.313 1.445 . . . . 3.82 112.391 168.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -80.58 67.0 6.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.278 -0.874 . . . . 2.43 110.115 -177.134 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 80.37 96.37 0.05 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.578 1.151 . . . . 2.73 112.132 -176.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.402 0 N-CA-C 102.704 -3.073 . . . . 6.67 102.704 155.308 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 107.318 -1.364 . . . . 4.43 107.318 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -143.49 1.68 Allowed Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.56 -1.416 . . . . 1.22 109.56 168.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.7 m -143.69 135.27 26.17 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 120.559 -1.554 . . . . 1.25 107.376 170.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.401 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -92.1 113.37 25.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 106.078 -1.823 . . . . 3.19 106.078 -173.642 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 7.2 m-85 -103.34 148.12 26.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 118.569 -0.729 . . . . 1.93 109.973 173.08 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -133.28 149.94 51.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.566 1.146 . . . . 1.46 112.228 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.685 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 6.0 m-90 -137.06 148.76 46.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 126.116 1.766 . . . . 0.48 110.227 173.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -97.61 122.37 40.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.846 -1.539 . . . . 3.31 106.846 172.004 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -121.37 86.89 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 121.886 0.85 . . . . 2.33 111.229 -169.704 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.37 84.77 4.52 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 108.561 -0.903 . . . . 1.97 108.561 -176.199 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 168.05 -28.87 0.16 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-N 116.121 -0.49 . . . . 1.38 113.18 -175.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.561 ' SD ' HG21 ' A' ' 22' ' ' VAL . 66.8 mtp -78.6 116.18 18.8 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.568 1.184 . . . . 2.58 111.288 -178.713 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -127.06 -10.16 5.94 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.899 1.28 . . . . 1.56 114.201 -173.131 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.3 m -135.42 153.22 51.87 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.338 0.972 . . . . 0.65 109.979 -169.37 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.78 76.79 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.528 0.331 . . . . 0.43 111.013 174.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.74 -50.22 73.26 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.583 -0.698 . . . . 0.3 109.89 175.026 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.3 m -53.86 -51.93 62.06 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.771 1.229 . . . . 0.5 108.95 175.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 -51.99 39.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.199 0.6 . . . . 0.33 111.995 173.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -60.75 -44.13 97.1 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.393 0.616 . . . . 3.23 110.467 -177.582 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.37 -43.6 92.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.183 -0.673 . . . . 3.58 109.183 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.561 HG21 ' SD ' ' A' ' 13' ' ' MET . 53.1 t -61.93 -53.5 47.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 123.46 0.704 . . . . 0.39 109.349 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -64.23 -36.08 82.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 120.286 -0.566 . . . . 2.09 109.618 -174.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -62.4 -48.37 79.99 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.377 0.535 . . . . 2.77 112.013 171.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.11 -35.28 73.16 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 124.67 1.188 . . . . 0.44 111.143 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.0 t -77.06 -54.38 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 123.95 0.9 . . . . 2.09 110.543 174.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -62.64 -29.33 70.54 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 121.268 -0.895 . . . . 3.34 111.73 -166.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -60.96 -17.51 52.03 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.824 1.046 . . . . 0.74 113.824 175.506 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.34 -76.63 0.06 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.735 1.152 . . . . 0.55 111.856 -173.34 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 168.95 -71.35 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.919 1.687 . . . . 0.46 110.719 -178.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -40.37 -51.12 3.73 Favored Glycine 0 C--N 1.342 0.895 0 C-N-CA 125.94 1.733 . . . . 0.37 113.172 -177.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -64.01 123.38 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 C-N-CA 125.262 1.425 . . . . 0.5 111.695 -171.019 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -97.26 -62.38 1.26 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.456 -1.313 . . . . 1.09 107.456 173.055 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -104.73 134.36 48.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.769 -1.197 . . . . 1.98 107.769 -176.408 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.8 m -106.34 139.69 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 C-N-CA 126.362 1.865 . . . . 2.48 106.667 173.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -144.38 80.57 1.64 Allowed 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.218 -1.401 . . . . 1.94 107.218 170.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.415 HG12 HD13 ' A' ' 44' ' ' LEU . 5.0 m -98.05 102.52 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.221 0.534 . . . . 1.88 110.198 -175.224 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.0 87.56 4.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.007 -1.479 . . . . 0.6 107.007 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -60.01 168.14 1.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.687 -1.597 . . . . 1.9 110.215 170.066 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 70.76 -56.83 0.61 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.133 1.773 . . . . 0.72 110.098 -176.385 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -73.06 0.98 9.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.44 1.496 . . . . 0.96 112.828 177.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 61.3 48.78 5.85 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.318 1.047 . . . . 4.06 111.315 172.638 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.54 119.65 5.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 120.418 1.463 . . . . 2.77 109.846 -176.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.755 HD12 ' N ' ' A' ' 45' ' ' VAL . 0.1 OUTLIER -107.75 147.86 30.24 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 105.876 -1.898 . . . . 1.0 105.876 171.686 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.755 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -135.54 141.06 43.37 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.312 0 C-N-CA 128.76 2.824 . . . . 0.28 105.791 175.855 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.552 HG11 HD11 ' A' ' 52' ' ' ILE . 71.3 t -131.1 143.34 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 125.063 1.345 . . . . 0.83 108.415 171.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -120.17 105.8 11.33 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.434 -1.321 . . . . 2.13 107.434 169.02 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -115.04 143.11 45.71 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 124.852 1.261 . . . . 1.12 110.789 -172.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -104.64 56.57 0.7 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 122.582 1.182 . . . . 2.84 110.343 176.331 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.483 ' ND2' ' H ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -168.8 -78.97 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 106.426 -1.694 . . . . 2.39 106.426 152.0 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.483 ' H ' ' ND2' ' A' ' 50' ' ' ASN . 8.8 t70 168.26 130.88 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.427 2.291 . . . . 2.59 107.537 -177.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.59 HD13 HG23 ' A' ' 56' ' ' VAL . 1.8 pp -151.94 8.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 124.573 1.149 . . . . 0.58 111.681 -175.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.83 -47.74 79.57 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 119.844 -1.785 . . . . 2.43 110.927 -161.97 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.46 -18.61 63.95 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.969 -1.014 . . . . 0.79 111.179 173.544 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -75.98 -49.27 18.14 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.921 1.289 . . . . 3.16 110.284 169.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.685 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 44.3 t -58.12 -52.59 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 125.574 1.55 . . . . 0.35 109.829 -179.561 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.598 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -58.6 -53.01 63.17 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.687 -0.486 . . . . 3.07 109.687 -174.433 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -36.91 73.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.388 -0.339 . . . . 1.4 110.615 172.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.11 84.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.776 1.171 . . . . 0.53 110.705 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.745 HD22 HD23 ' A' ' 67' ' ' LEU . 4.1 mp -58.92 -44.71 91.37 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.321 0.648 . . . . 0.57 109.648 172.809 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -54.8 -45.06 74.3 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.597 -0.52 . . . . 4.49 109.597 177.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -70.46 -41.67 72.5 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.984 0.913 . . . . 4.76 110.291 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.53 -35.22 71.95 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.619 0.368 . . . . 0.84 110.688 172.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.97 47.96 0.23 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.05 1.309 . . . . 0.74 111.671 169.212 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -123.2 -178.91 4.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.146 0.979 . . . . 1.78 110.083 177.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -147.18 67.62 1.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.387 1.875 . . . . 1.78 107.805 -172.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.745 HD23 HD22 ' A' ' 60' ' ' LEU . 1.9 pp -78.98 178.06 8.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 120.999 0.428 . . . . 2.16 111.653 179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -143.46 134.69 25.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.007 0.523 . . . . 5.09 109.676 168.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -34.4 133.07 0.26 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.675 1.99 . . . . 2.49 113.233 173.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.81 55.33 1.72 Allowed 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.7 0.625 . . . . 2.4 110.964 170.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 58.85 -178.32 0.08 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 122.458 1.123 . . . . 4.94 112.438 174.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -130.48 96.59 4.17 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.259 1.024 . . . . 2.01 108.977 -179.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 56.35 43.4 26.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.014 1.326 . . . . 3.0 111.228 176.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--O 1.262 1.717 0 N-CA-C 103.77 -2.678 . . . . 7.95 103.77 165.87 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.384 -0.598 . . . . 6.52 109.384 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.01 -168.35 37.2 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.279 0.942 . . . . 2.64 111.482 170.247 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.74 113.86 25.54 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 105.767 -1.938 . . . . 1.46 105.767 -166.612 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.35 140.92 29.03 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 106.814 -1.55 . . . . 2.62 106.814 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.767 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 18.2 m-85 -134.77 137.24 43.23 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 107.039 -1.467 . . . . 1.9 107.039 -176.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.3 m -120.27 152.13 38.21 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.794 0.725 . . . . 1.69 111.427 -174.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.767 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 8.3 m-90 -138.08 140.2 39.89 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.844 1.258 . . . . 0.32 109.851 174.018 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -98.55 116.76 31.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.084 1.354 . . . . 1.95 107.561 177.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -125.58 104.0 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 113.4 0.889 . . . . 2.07 113.4 -166.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.0 p -75.54 67.67 2.08 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.105 0.962 . . . . 2.62 110.323 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.67 -44.6 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 CA-C-O 119.539 -0.59 . . . . 1.3 113.823 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 mtm -59.72 118.95 6.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.508 1.154 . . . . 2.34 112.167 -175.02 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 p-10 -132.49 -29.28 1.57 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.893 1.677 . . . . 1.56 113.978 -161.218 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -133.28 158.68 42.32 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 126.054 1.742 . . . . 0.84 109.525 -171.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.4 75.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.026 0.441 . . . . 0.57 111.385 175.225 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.03 -47.74 79.07 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.393 -0.817 . . . . 0.46 109.95 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -58.46 -50.38 73.93 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.531 1.132 . . . . 0.66 108.641 177.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -47.15 -59.96 2.79 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.687 0.795 . . . . 0.36 111.322 170.705 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -49.71 -47.34 50.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 118.522 0.601 . . . . 4.72 110.988 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mttt -61.53 -44.26 97.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.052 -0.405 . . . . 3.02 110.686 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.93 -51.81 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 109.341 -0.614 . . . . 0.41 109.341 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -62.66 -41.28 98.97 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.898 -0.721 . . . . 2.06 109.549 -174.549 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -59.99 -55.11 38.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 119.224 -0.417 . . . . 2.61 110.076 175.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.46 -36.93 24.2 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.625 1.17 . . . . 0.44 111.724 179.373 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.519 HG13 HG22 ' A' ' 56' ' ' VAL . 80.8 t -76.59 -48.44 26.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-O 120.861 0.363 . . . . 2.02 111.23 174.684 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -54.61 -27.92 42.79 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.414 1.086 . . . . 1.69 112.469 -174.408 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -57.97 -24.08 56.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.456 0.702 . . . . 1.34 112.592 178.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 26.7 mt -66.78 -75.14 0.1 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.343 0.519 . . . . 0.54 111.512 -164.382 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 163.13 -63.08 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 126.805 2.042 . . . . 0.52 110.401 178.243 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.3 -42.83 25.83 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.977 1.275 . . . . 0.48 113.069 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -63.15 123.63 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 C-N-CA 124.562 1.145 . . . . 0.42 111.477 -178.323 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -96.49 -57.94 2.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.355 -1.35 . . . . 1.28 107.355 172.623 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -117.98 119.0 33.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.361 -1.348 . . . . 2.36 107.361 -170.269 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.6 m -85.51 142.99 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 C-N-CA 124.196 0.999 . . . . 2.6 108.999 173.53 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -149.83 79.56 1.37 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.684 0.754 . . . . 1.62 109.769 167.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.864 HG12 HD13 ' A' ' 44' ' ' LEU . 18.9 m -90.45 106.42 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 C-N-CA 126.174 1.79 . . . . 1.66 107.1 178.028 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 39.9 tp -102.16 85.15 2.6 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.609 -1.256 . . . . 0.51 107.609 -179.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -59.3 164.85 2.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.382 -1.281 . . . . 1.89 111.242 175.07 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.88 -43.59 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.072 1.749 . . . . 0.56 111.412 -176.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.3 m -80.99 7.93 9.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.591 1.556 . . . . 0.92 111.005 173.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 59.61 30.6 20.23 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.189 -0.91 . . . . 4.15 112.137 171.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.73 157.6 44.28 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 120.793 1.633 . . . . 3.12 113.833 178.118 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.864 HD13 HG12 ' A' ' 37' ' ' VAL . 0.4 OUTLIER -134.53 150.16 50.73 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 105.531 -2.026 . . . . 0.65 105.531 172.043 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.733 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 t -136.68 123.18 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 1 C-N-CA 131.786 4.035 . . . . 0.36 101.934 -179.99 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.734 HG23 HD11 ' A' ' 44' ' ' LEU . 53.4 t -114.67 136.06 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.024 -1.843 . . . . 0.9 106.024 171.382 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.97 106.02 16.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 106.784 -1.561 . . . . 2.35 106.784 175.494 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -124.53 139.3 54.01 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.592 1.157 . . . . 0.9 111.077 -166.18 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -121.38 57.65 1.01 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 122.687 1.232 . . . . 2.38 109.015 177.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -157.64 -94.86 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 102.808 -3.034 . . . . 2.6 102.808 158.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 t0 173.02 129.44 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 128.319 2.647 . . . . 2.13 105.303 170.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.3 pp -149.91 8.44 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 124.441 1.096 . . . . 0.41 111.501 -176.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -48.29 81.63 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.07 -1.644 . . . . 2.77 109.974 -164.597 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 57' ' ' GLU . . . -55.04 -35.21 64.22 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.965 -1.016 . . . . 0.47 110.34 174.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -66.72 -47.55 71.98 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.576 0.75 . . . . 2.65 110.686 173.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.628 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 95.2 t -55.08 -53.5 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 109.312 -0.625 . . . . 0.47 109.312 177.205 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.512 ' HB2' HD21 ' A' ' 67' ' ' LEU . 15.9 pt-20 -64.7 -44.95 88.63 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 120.597 -0.441 . . . . 2.75 110.006 -171.617 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.2 t -51.65 -45.68 63.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.4 -0.363 . . . . 0.89 110.501 168.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.46 62.4 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.44 -0.788 . . . . 0.38 110.878 -172.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.623 HD22 HD13 ' A' ' 67' ' ' LEU . 5.8 mp -57.51 -46.23 84.02 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.239 1.016 . . . . 0.39 109.925 174.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -56.91 -45.1 82.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.048 -0.407 . . . . 1.48 110.304 176.637 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -66.47 -39.59 88.89 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.05 0.94 . . . . 3.99 111.198 -179.266 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.25 93.37 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.266 1.026 . . . . 0.5 110.585 175.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 128.84 46.5 0.18 Allowed Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.558 1.075 . . . . 0.45 112.339 170.158 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -118.59 178.53 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.297 1.039 . . . . 1.92 110.379 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.6 m -137.48 71.16 1.4 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.368 1.067 . . . . 1.45 108.987 178.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -81.88 171.63 14.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.465 -0.789 . . . . 1.59 112.495 173.14 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 144.59 24.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.262 -1.755 . . . . 6.39 106.262 171.518 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -40.14 133.18 1.79 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 124.92 1.288 . . . . 2.71 111.282 170.417 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -123.04 51.22 1.46 Allowed 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.028 -1.101 . . . . 2.33 108.028 170.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 55.63 -179.56 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.738 1.256 . . . . 3.76 111.825 -177.063 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.72 55.09 1.27 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.803 0.841 . . . . 1.89 109.561 -167.106 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 75.95 139.43 0.07 Allowed 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 124.76 1.288 . . . . 2.85 109.332 -157.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 117.222 -1.37 . . . . 7.47 107.589 167.994 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 109.659 -0.496 . . . . 3.96 109.659 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.03 -168.6 13.22 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.486 -0.645 . . . . 1.24 111.486 172.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.47 119.14 31.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.738 -1.578 . . . . 1.58 106.738 -173.433 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.54 125.96 43.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.865 -1.161 . . . . 3.07 107.865 -176.683 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.737 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 25.6 m-85 -121.39 175.36 6.21 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.854 1.262 . . . . 2.06 111.331 -173.218 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 47.2 m -154.53 151.49 28.96 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.431 1.014 . . . . 1.47 111.803 171.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.737 ' HZ2' ' HB3' ' A' ' 6' ' ' TYR . 19.0 m-90 -135.5 147.4 48.83 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 124.191 0.996 . . . . 0.37 108.745 167.417 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.87 122.44 40.99 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 106.342 -1.725 . . . . 1.98 106.342 171.148 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.478 HG22 ' HB3' ' A' ' 67' ' ' LEU . 2.8 t -128.24 96.17 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.709 0.686 . . . . 3.08 110.345 -169.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -74.09 50.88 0.39 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.324 1.45 . . . . 2.51 113.618 -173.353 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -169.34 25.58 0.11 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.067 -0.852 . . . . 2.13 112.986 177.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.5 ttm -118.81 102.53 8.88 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.337 1.068 . . . . 2.19 108.241 -177.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -131.95 -8.5 3.49 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.13 1.159 . . . . 1.81 114.13 -161.143 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -135.56 155.74 49.99 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.381 -0.97 . . . . 0.7 108.381 -172.774 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.21 -35.74 81.22 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.675 0.274 . . . . 0.37 110.966 175.374 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.58 -51.7 68.31 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.795 -0.566 . . . . 0.3 109.732 175.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.7 m -51.73 -53.04 43.84 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.041 0.936 . . . . 0.57 108.905 173.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.71 -53.8 22.56 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.867 0.467 . . . . 0.32 111.476 176.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -58.01 -37.26 73.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 119.002 0.819 . . . . 4.37 111.77 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -65.76 -43.6 88.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.242 -0.912 . . . . 4.0 109.871 178.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.03 -53.11 36.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 C-N-CA 123.809 0.844 . . . . 0.42 110.12 -179.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -52.39 -41.54 63.22 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 108.0 -1.111 . . . . 2.42 108.0 -179.363 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -69.37 -53.46 19.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 122.735 0.414 . . . . 2.86 110.233 -176.098 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.638 1.175 . . . . 0.42 111.323 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.523 HG13 HG22 ' A' ' 56' ' ' VAL . 40.7 t -81.57 -53.15 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 122.219 0.208 . . . . 2.13 111.388 173.063 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -52.87 -38.89 62.11 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.368 -0.833 . . . . 1.76 111.57 -174.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.37 -16.52 36.14 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.827 1.047 . . . . 0.81 113.827 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 94.4 mt -59.85 -73.47 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.769 1.168 . . . . 0.53 112.075 -173.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 165.6 -68.43 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 126.543 1.937 . . . . 0.54 109.995 -179.23 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.595 ' HA3' HG21 ' A' ' 52' ' ' ILE . . . -43.6 -51.41 6.73 Favored Glycine 0 C--N 1.34 0.803 0 C-N-CA 125.547 1.546 . . . . 0.48 113.372 -177.037 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.98 125.5 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.898 0 C-N-CA 124.421 1.088 . . . . 0.47 111.539 -167.684 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.11 -52.15 3.62 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.042 0.937 . . . . 1.28 109.768 -177.337 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -122.19 137.46 54.82 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 108.517 -0.92 . . . . 2.86 108.517 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.2 m -106.74 141.63 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 126.058 1.743 . . . . 2.26 107.411 176.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -143.16 85.62 1.87 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.402 -1.332 . . . . 1.83 107.402 172.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.1 m -96.99 104.98 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 109.015 -0.735 . . . . 1.75 109.015 -177.459 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.0 tp -98.64 85.01 3.25 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 107.734 -1.21 . . . . 0.51 107.734 -174.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -59.22 165.42 2.63 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.636 -1.62 . . . . 1.96 110.381 172.602 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 71.61 -54.43 0.67 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.076 1.75 . . . . 0.53 110.82 -178.062 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.6 m -68.65 -6.03 23.59 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.311 1.044 . . . . 0.93 112.1 169.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 71.24 30.7 2.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.933 1.293 . . . . 3.84 112.395 167.91 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 152.28 40.84 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 119.803 1.183 . . . . 2.22 113.675 178.441 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.738 HD11 HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -122.74 148.9 44.79 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.043 -1.836 . . . . 0.85 106.043 173.164 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.715 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.3 t -134.2 138.71 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.218 0 C-N-CA 130.288 3.435 . . . . 0.35 103.391 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.738 HG23 HD11 ' A' ' 44' ' ' LEU . 42.4 t -130.66 141.08 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.586 -1.635 . . . . 0.73 106.586 175.078 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -110.87 112.19 23.87 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 104.577 -2.379 . . . . 2.14 104.577 170.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -132.49 142.99 49.46 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.175 -1.417 . . . . 0.92 107.175 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.13 54.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.077 -1.453 . . . . 2.79 107.077 -172.144 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 158.07 -166.4 0.0 OUTLIER 'General case' 0 C--O 1.238 0.482 0 N-CA-C 103.208 -2.886 . . . . 3.5 103.208 -163.931 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -133.67 121.36 21.87 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 118.786 0.721 . . . . 2.18 112.853 -159.591 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.595 HG21 ' HA3' ' A' ' 31' ' ' GLY . 2.7 pp -150.97 7.99 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 115.331 -0.849 . . . . 0.65 113.181 -169.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 mtm105 -65.0 -40.03 94.33 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 120.526 1.512 . . . . 2.11 109.785 -166.497 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.96 85.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.517 0.675 . . . . 0.56 110.179 173.888 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -58.97 -47.69 84.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.176 -0.952 . . . . 3.89 111.644 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.671 HG21 ' HZ3' ' A' ' 8' ' ' TRP . 73.5 t -55.83 -58.13 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.502 0.592 . . . . 0.52 109.551 178.416 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -62.94 -42.63 99.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.175 -0.466 . . . . 3.01 109.957 -171.694 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.1 t -56.69 -40.02 74.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.403 0.281 . . . . 0.89 110.771 170.207 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.73 67.85 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.781 -0.575 . . . . 0.38 110.467 -175.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.02 -46.12 92.05 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.118 0.967 . . . . 0.49 109.961 175.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.53 -51.32 68.98 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.213 -0.662 . . . . 1.56 109.213 176.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.48 -43.39 75.52 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.209 1.004 . . . . 5.48 110.981 176.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -18.13 65.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.18 0.992 . . . . 0.73 112.491 177.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 108.86 32.76 3.0 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 124.714 1.15 . . . . 0.55 112.478 172.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -108.37 -178.82 3.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.478 1.111 . . . . 1.85 109.332 174.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.5 m -150.87 68.31 0.95 Allowed 'General case' 0 C--O 1.228 -0.068 0 O-C-N 121.136 -0.977 . . . . 1.91 110.129 179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.478 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.2 OUTLIER -82.23 179.15 7.91 Favored 'General case' 0 C--O 1.23 0.05 0 N-CA-C 114.421 1.267 . . . . 2.07 114.421 175.331 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -145.06 146.82 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.032 1.733 . . . . 3.99 106.511 171.492 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.411 ' HA ' ' CD1' ' A' ' 8' ' ' TRP . 12.4 t70 -69.57 136.76 51.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.718 1.207 . . . . 3.42 111.835 -176.005 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -118.51 56.55 0.88 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.534 1.133 . . . . 2.49 110.391 175.112 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 66.62 -179.45 0.21 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.592 1.157 . . . . 3.71 111.479 165.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -106.17 64.87 0.68 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.941 0.896 . . . . 1.96 108.859 175.351 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 60.22 54.21 4.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.889 0.876 . . . . 2.66 111.773 -177.243 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.255 1.382 0 N-CA-C 104.819 -2.289 . . . . 7.95 104.819 171.548 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 4.88 108.73 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 1.33 107.697 -175.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 1.02 107.035 173.937 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.78 112.76 175.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 1.94 107.077 174.166 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.64 111.751 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.83 102.189 151.753 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 108.73 -0.841 . . . . 4.88 108.73 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 119.64 -170.66 14.14 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 107.697 -2.161 . . . . 1.33 107.697 -175.751 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.09 128.67 20.26 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.035 -1.469 . . . . 1.02 107.035 173.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -95.41 129.13 42.68 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.995 -1.483 . . . . 2.35 106.995 179.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.57 ' HB3' ' HZ2' ' A' ' 8' ' ' TRP . 16.8 m-85 -130.07 108.78 10.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 118.182 0.446 . . . . 1.94 109.947 -176.656 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -98.48 152.03 19.97 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.777 0.831 . . . . 1.96 112.196 -177.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.718 ' CZ3' HG11 ' A' ' 56' ' ' VAL . 7.6 m-90 -133.32 135.17 44.64 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.614 1.165 . . . . 0.45 108.856 171.745 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -102.72 135.52 44.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.134 -1.802 . . . . 1.73 106.134 176.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG21 ' HB3' ' A' ' 65' ' ' TYR . 7.8 p -139.03 -174.6 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 124.603 1.161 . . . . 2.44 108.579 -178.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.424 ' N ' HG22 ' A' ' 10' ' ' VAL . 5.3 t -139.15 133.19 31.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.182 -1.784 . . . . 2.88 106.182 148.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.77 -42.98 0.81 Allowed Glycine 0 CA--C 1.534 1.241 0 CA-C-N 118.321 0.509 . . . . 1.44 113.037 -176.677 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.9 ptm -71.72 92.66 1.21 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.346 -1.09 . . . . 2.62 111.327 -177.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.66 -6.4 11.61 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.902 1.816 . . . . 1.53 115.902 -168.397 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.1 m -136.49 158.85 43.45 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.739 1.154 . . . . 0.66 109.147 -168.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.1 95.93 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.598 0.359 . . . . 0.46 111.041 175.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.33 82.29 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.784 -0.573 . . . . 0.26 110.216 178.4 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' O ' HG23 ' A' ' 22' ' ' VAL . 69.5 m -52.18 -55.99 17.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.076 0.951 . . . . 0.51 108.977 172.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.79 -48.67 41.05 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.961 0.904 . . . . 0.32 110.439 179.268 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -68.26 -39.31 82.26 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 119.827 -0.749 . . . . 3.36 111.685 -177.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -59.04 -37.82 77.86 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.457 -0.777 . . . . 2.96 109.782 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 18' ' ' CYS . 21.8 t -65.78 -49.13 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 109.51 -0.552 . . . . 0.78 109.51 176.33 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -59.21 -41.59 88.94 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.206 -0.664 . . . . 2.03 109.206 -176.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.31 -49.16 78.91 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.042 1.337 . . . . 2.65 111.498 172.543 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -40.45 68.87 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 124.168 0.987 . . . . 0.85 111.203 -178.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 56' ' ' VAL . 10.4 m -81.04 -46.94 20.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.595 0.236 . . . . 1.87 111.061 175.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -58.61 -32.83 69.36 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 121.592 -0.692 . . . . 2.05 111.631 -168.68 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -62.1 -17.5 57.87 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.679 0.992 . . . . 1.04 113.679 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 85.2 mt -64.05 -79.96 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.151 0.887 . . . . 0.47 112.148 -172.721 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 29' ' ' LEU . . . 166.44 -74.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.674 1.589 . . . . 0.35 111.394 -173.525 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -46.21 -36.3 7.24 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 126.304 1.907 . . . . 0.39 114.055 -174.673 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.24 125.51 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 C-N-CA 124.593 1.157 . . . . 0.47 112.274 -176.003 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -94.7 -51.91 4.51 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.697 -1.223 . . . . 1.51 107.697 177.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -128.68 138.13 51.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.181 -1.414 . . . . 2.09 107.181 -176.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 24.6 m -101.33 142.24 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 C-N-CA 125.716 1.606 . . . . 2.56 107.949 174.224 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -143.01 85.76 1.89 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.076 -1.083 . . . . 1.75 108.076 169.162 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.576 HG22 HD13 ' A' ' 44' ' ' LEU . 87.7 t -93.48 106.5 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 107.371 -1.344 . . . . 2.35 107.371 175.174 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 44.9 tp -103.75 93.67 5.02 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.92 -1.141 . . . . 0.85 107.92 173.354 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -64.57 174.87 1.57 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.699 -1.137 . . . . 1.91 111.089 176.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 74.07 -53.9 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 126.291 1.836 . . . . 0.78 109.42 -176.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 m -86.25 16.05 4.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.365 1.066 . . . . 1.32 111.95 171.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 44.15 43.23 5.56 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 3.1 114.87 165.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -134.31 115.4 14.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.659 1.184 . . . . 2.99 107.846 -175.372 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD13 HG22 ' A' ' 37' ' ' VAL . 3.4 tp -98.29 154.56 17.72 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 105.385 -2.08 . . . . 0.9 105.385 167.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.4 t -142.17 130.02 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 1 C-N-CA 132.243 4.217 . . . . 0.46 103.196 173.73 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.496 HG11 HD11 ' A' ' 52' ' ' ILE . 91.2 t -117.98 138.33 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 106.324 -1.732 . . . . 0.97 106.324 166.319 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -111.78 100.61 9.07 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 105.67 -1.974 . . . . 2.18 105.67 175.217 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -121.83 139.31 53.78 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.664 1.185 . . . . 0.69 110.296 -172.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.32 57.61 0.76 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 107.717 -1.216 . . . . 2.17 107.717 177.366 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -161.21 -103.49 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 104.788 -2.301 . . . . 2.52 104.788 167.533 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 57.6 t0 178.74 101.86 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 125.538 1.535 . . . . 2.35 107.128 -172.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.496 HD11 HG11 ' A' ' 46' ' ' VAL . 2.6 pp -139.38 2.24 0.61 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 123.754 0.822 . . . . 0.43 111.698 -174.714 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -69.24 -42.96 74.94 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.705 -1.247 . . . . 2.71 110.262 -158.289 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.62 -37.1 84.98 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.436 -0.802 . . . . 0.56 109.24 174.615 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mp0 -56.55 -47.72 78.85 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.332 -0.855 . . . . 3.78 111.724 169.798 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.718 HG11 ' CZ3' ' A' ' 8' ' ' TRP . 34.7 t -60.46 -55.93 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 123.848 0.859 . . . . 0.57 110.95 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.428 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -42.38 97.74 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.555 -0.535 . . . . 2.72 109.555 -174.568 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.4 t -55.06 -41.33 71.33 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.079 -0.388 . . . . 0.87 110.347 169.625 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.8 -48.79 70.56 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 121.647 -0.658 . . . . 0.35 110.296 -177.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.436 ' CD2' HD13 ' A' ' 67' ' ' LEU . 5.6 mp -57.53 -43.06 84.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.445 0.698 . . . . 0.45 110.582 174.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -60.39 -42.57 96.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 122.104 -0.373 . . . . 1.47 110.32 176.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -59.84 -47.56 85.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.563 0.745 . . . . 2.93 111.039 174.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.1 -37.97 87.08 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.401 0.68 . . . . 0.56 110.807 178.344 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.55 43.25 0.29 Allowed Glycine 0 CA--C 1.528 0.89 0 C-N-CA 125.025 1.297 . . . . 0.58 112.454 170.337 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.534 ' HB3' HG21 ' A' ' 10' ' ' VAL . 97.5 m-85 -122.95 139.04 54.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.336 1.055 . . . . 1.99 109.999 177.786 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.401 ' C ' HG23 ' A' ' 10' ' ' VAL . 46.4 t -98.63 59.12 1.25 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.28 1.032 . . . . 2.27 110.545 -169.537 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' HB3' ' A' ' 8' ' ' TRP . 0.4 OUTLIER -79.09 177.98 8.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 115.015 1.487 . . . . 1.72 115.015 -174.683 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 tpp85 -155.18 143.93 20.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 107.182 -1.414 . . . . 3.94 107.182 176.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -45.07 130.07 7.61 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 125.28 1.432 . . . . 2.76 111.322 173.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.07 54.75 0.91 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.761 0.824 . . . . 2.16 109.194 172.635 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 67.07 151.8 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.651 1.58 . . . . 3.78 112.76 175.142 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.28 87.02 6.97 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.077 -1.453 . . . . 1.94 107.077 174.166 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 77.12 178.07 0.16 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.219 1.407 . . . . 2.64 111.751 179.168 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 . . . . . 0 C--O 1.257 1.464 0 N-CA-C 102.189 -3.263 . . . . 7.83 102.189 151.753 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_