data_1gdc_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 1gdc _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 full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 95.0 mt . . . . . 0 CA--C 1.499 -0.986 0 CA-C-O 120.759 0.314 . . . . 0.0 110.304 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.472 ' HB3' ' H ' ' A' ' 7' ' ' ASP . 50.8 t -66.94 128.76 37.54 Favored 'General case' 0 C--N 1.372 1.577 0 C-N-CA 129.409 3.083 . . . . 0.0 102.869 177.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.27 20.66 16.4 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-O 122.466 1.127 . . . . 0.0 111.376 -174.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -120.21 -70.07 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.431 0 C-N-CA 125.905 1.682 . . . . 0.0 108.959 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.1 p -105.63 24.48 12.16 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -175.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 39.08 54.83 2.13 Favored 'General case' 0 C--N 1.362 1.119 0 C-N-CA 127.541 2.336 . . . . 0.0 116.446 166.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.472 ' H ' ' HB3' ' A' ' 2' ' ' CYS . 36.0 t70 -124.11 172.73 8.79 Favored 'General case' 0 CA--C 1.499 -1.004 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.07 113.37 6.38 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.172 1.389 . . . . 0.0 108.717 176.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.12 144.16 31.89 Favored 'General case' 0 C--N 1.363 1.166 0 CA-C-O 121.517 0.675 . . . . 0.0 109.982 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 79.7 p -84.45 -35.37 23.06 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 125.444 1.497 . . . . 0.0 109.75 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.52 162.41 21.72 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 105.674 -2.97 . . . . 0.0 105.674 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.6 p -80.87 149.29 29.55 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.879 1.272 . . . . 0.0 109.817 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.56 138.19 11.88 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 104.386 -2.45 . . . . 0.0 104.386 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . 0.334 19.9 m-85 82.17 -115.14 0.01 OUTLIER 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.646 -2.724 . . . . 0.0 103.646 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -103.24 -16.82 19.75 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-O 118.046 -1.419 . . . . 0.0 115.497 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.93 163.97 18.99 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-N 120.368 2.084 . . . . 0.0 110.429 -167.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.6 tp -74.0 104.26 4.78 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.777 2.831 . . . . 0.0 106.466 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.78 174.95 9.24 Favored 'General case' 0 CA--C 1.484 -1.562 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 2' ' ' CYS . 28.1 p -80.52 -159.02 0.21 Allowed 'General case' 0 C--N 1.36 1.057 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.01 -42.05 8.31 Favored Glycine 0 C--N 1.353 1.52 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 m -74.01 -35.78 64.41 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 125.879 1.671 . . . . 0.0 114.127 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . 0.253 64.0 m -68.94 -20.38 64.21 Favored 'General case' 0 C--N 1.373 1.612 0 C-N-CA 125.575 1.55 . . . . 0.0 112.658 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -64.52 -65.38 0.68 Allowed 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 127.714 2.406 . . . . 0.0 108.595 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -60.87 -37.75 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 C-N-CA 128.623 2.769 . . . . 0.0 113.303 -176.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -56.7 -55.03 39.29 Favored 'General case' 0 CA--C 1.496 -1.115 0 C-N-CA 129.742 3.217 . . . . 0.0 110.315 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -64.84 -41.57 95.61 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.805 2.442 . . . . 0.0 112.093 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.286 40.1 ttpt -69.02 -27.29 65.54 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.163 0.985 . . . . 0.0 110.995 -178.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -79.66 -43.4 22.85 Favored 'General case' 0 C--N 1.365 1.272 0 C-N-CA 125.81 1.644 . . . . 0.0 109.743 174.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -14.24 62.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 129.161 2.984 . . . . 0.0 114.643 -174.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.4 t -104.37 -69.24 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 C-N-CA 125.192 1.397 . . . . 0.0 107.337 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -98.44 60.32 1.35 Allowed 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.996 1.718 . . . . 0.0 109.327 -174.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.97 -155.78 9.65 Favored Glycine 0 CA--C 1.494 -1.262 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.57 141.55 49.17 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 155.01 51.02 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -172.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -146.58 70.0 1.2 Allowed 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -119.98 138.7 53.33 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 103.919 -2.622 . . . . 0.0 103.919 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -122.22 115.31 22.15 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-O 121.666 0.746 . . . . 0.0 112.761 -174.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.3 m -175.22 52.72 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 101.265 -3.606 . . . . 0.0 101.265 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -95.18 -14.07 24.44 Favored 'General case' 0 N--CA 1.438 -1.04 0 C-N-CA 129.002 2.921 . . . . 0.0 110.064 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -152.95 20.3 0.76 Allowed Glycine 0 C--N 1.351 1.394 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -122.1 -91.09 0.56 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 101.751 -3.425 . . . . 0.0 101.751 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.63 61.25 0.28 Allowed 'General case' 0 C--N 1.357 0.909 0 C-N-CA 128.909 2.883 . . . . 0.0 105.782 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -110.85 -54.23 2.62 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.552 -1.204 . . . . 0.0 111.891 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 145.61 44.3 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 126.039 1.736 . . . . 0.0 115.209 -171.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.5 mm -96.64 135.14 31.75 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 N-CA-C 103.446 -2.798 . . . . 0.0 103.446 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.434 HG21 ' HA ' ' A' ' 58' ' ' ARG . 1.0 OUTLIER -109.5 117.58 54.84 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.971 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 -177.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -148.89 -162.83 1.64 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -61.16 -14.61 26.18 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 127.312 2.245 . . . . 0.0 116.209 -174.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 46.7 mm -121.76 -53.52 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 C-N-CA 124.995 1.318 . . . . 0.0 110.548 -173.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -75.93 -0.14 20.39 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.806 2.042 . . . . 0.0 114.933 -171.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.324 0.0 OUTLIER -75.45 -13.52 60.39 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.453 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -81.99 -13.53 57.3 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 126.466 1.907 . . . . 0.0 110.359 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -85.54 -28.0 25.2 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.01 1.724 . . . . 0.0 109.119 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.7 t -163.04 124.47 1.55 Allowed Pre-proline 0 C--N 1.361 1.089 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -101.85 24.56 0.14 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 124.031 3.154 . . . . 0.0 111.043 168.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.95 -49.46 4.12 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.113 1.765 . . . . 0.0 108.199 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 68.8 m -57.07 -34.0 67.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 127.845 2.458 . . . . 0.0 114.128 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.434 ' HA ' HG21 ' A' ' 46' ' ' ILE . 10.9 mtm180 -60.6 -32.14 71.27 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 127.372 2.269 . . . . 0.0 112.515 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -75.66 -38.44 58.79 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.16 -36.39 74.67 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.121 1.768 . . . . 0.0 111.78 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -71.68 -48.84 44.72 Favored 'General case' 0 CA--C 1.499 -0.987 0 C-N-CA 128.293 2.637 . . . . 0.0 111.843 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.4 ' HB2' ' HG3' ' A' ' 67' ' ' MET . 13.6 p -63.76 -34.51 78.05 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 126.554 1.942 . . . . 0.0 111.69 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.6 mt -69.64 -38.9 77.33 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 126.359 1.864 . . . . 0.0 110.515 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.68 -32.56 73.96 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 125.316 1.446 . . . . 0.0 110.737 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.79 -34.32 77.57 Favored 'General case' 0 C--N 1.359 0.978 0 C-N-CA 127.317 2.247 . . . . 0.0 111.728 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 120.85 22.63 2.94 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 125.061 1.315 . . . . 0.0 112.532 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.4 ' HG3' ' HB2' ' A' ' 62' ' ' CYS . 70.2 mmm -67.71 143.07 56.1 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-N 118.569 1.184 . . . . 0.0 110.252 -177.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -164.64 128.47 2.49 Favored 'General case' 0 CA--C 1.485 -1.549 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.7 tp -87.8 17.17 4.99 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 127.316 2.246 . . . . 0.0 109.712 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -158.02 62.43 0.46 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 101.815 -3.402 . . . . 0.0 101.815 176.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.26 -131.7 0.29 Allowed 'General case' 0 C--N 1.353 0.719 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 47.5 ttp85 . . . . . 0 C--O 1.26 1.658 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 95.0 mt . . . . . 0 CA--C 1.499 -0.986 0 CA-C-O 120.759 0.314 . . . . 0.0 110.304 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 7' ' ' ASP . 50.8 t -66.94 128.76 37.54 Favored 'General case' 0 C--N 1.372 1.577 0 C-N-CA 129.409 3.083 . . . . 0.0 102.869 177.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.27 20.66 16.4 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-O 122.466 1.127 . . . . 0.0 111.376 -174.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -120.21 -70.07 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.431 0 C-N-CA 125.905 1.682 . . . . 0.0 108.959 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.1 p -105.63 24.48 12.16 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -175.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 39.08 54.83 2.13 Favored 'General case' 0 C--N 1.362 1.119 0 C-N-CA 127.541 2.336 . . . . 0.0 116.446 166.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.489 ' H ' ' HB3' ' A' ' 2' ' ' CYS . 36.0 t70 -124.11 172.73 8.79 Favored 'General case' 0 CA--C 1.499 -1.004 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.07 113.37 6.38 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.172 1.389 . . . . 0.0 108.717 176.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.491 ' HB1' ' O ' ' A' ' 18' ' ' THR . . . -81.12 144.16 31.89 Favored 'General case' 0 C--N 1.363 1.166 0 CA-C-O 121.517 0.675 . . . . 0.0 109.982 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 79.7 p -84.45 -35.37 23.06 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 125.444 1.497 . . . . 0.0 109.75 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.52 162.41 21.72 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 105.674 -2.97 . . . . 0.0 105.674 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.6 p -80.87 149.29 29.55 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.879 1.272 . . . . 0.0 109.817 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.56 138.19 11.88 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 104.386 -2.45 . . . . 0.0 104.386 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 68' ' ' ASN 0.334 19.9 m-85 82.17 -115.14 0.01 OUTLIER 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.646 -2.724 . . . . 0.0 103.646 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -103.24 -16.82 19.75 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-O 118.046 -1.419 . . . . 0.0 115.497 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.442 HG23 ' HA ' ' A' ' 67' ' ' MET . 11.5 t -141.93 163.97 18.99 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-N 120.368 2.084 . . . . 0.0 110.429 -167.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.6 tp -74.0 104.26 4.78 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.777 2.831 . . . . 0.0 106.466 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.491 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -129.78 174.95 9.24 Favored 'General case' 0 CA--C 1.484 -1.562 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 -175.026 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 2' ' ' CYS . 28.1 p -80.52 -159.02 0.21 Allowed 'General case' 0 C--N 1.36 1.057 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.01 -42.05 8.31 Favored Glycine 0 C--N 1.353 1.52 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 m -74.01 -35.78 64.41 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 125.879 1.671 . . . . 0.0 114.127 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . 0.253 64.0 m -68.94 -20.38 64.21 Favored 'General case' 0 C--N 1.373 1.612 0 C-N-CA 125.575 1.55 . . . . 0.0 112.658 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -64.52 -65.38 0.68 Allowed 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 127.714 2.406 . . . . 0.0 108.595 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -60.87 -37.75 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 C-N-CA 128.623 2.769 . . . . 0.0 113.303 -176.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -56.7 -55.03 39.29 Favored 'General case' 0 CA--C 1.496 -1.115 0 C-N-CA 129.742 3.217 . . . . 0.0 110.315 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.616 ' O ' HG23 ' A' ' 30' ' ' VAL . 70.7 t80 -64.84 -41.57 95.61 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.805 2.442 . . . . 0.0 112.093 -175.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.286 40.1 ttpt -69.02 -27.29 65.54 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.163 0.985 . . . . 0.0 110.995 -178.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -79.66 -43.4 22.85 Favored 'General case' 0 C--N 1.365 1.272 0 C-N-CA 125.81 1.644 . . . . 0.0 109.743 174.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -14.24 62.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 129.161 2.984 . . . . 0.0 114.643 -174.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 26' ' ' PHE . 77.4 t -104.37 -69.24 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 C-N-CA 125.192 1.397 . . . . 0.0 107.337 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -98.44 60.32 1.35 Allowed 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.996 1.718 . . . . 0.0 109.327 -174.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.97 -155.78 9.65 Favored Glycine 0 CA--C 1.494 -1.262 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.57 141.55 49.17 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 155.01 51.02 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -172.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -146.58 70.0 1.2 Allowed 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -119.98 138.7 53.33 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 103.919 -2.622 . . . . 0.0 103.919 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -122.22 115.31 22.15 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-O 121.666 0.746 . . . . 0.0 112.761 -174.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.3 m -175.22 52.72 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 101.265 -3.606 . . . . 0.0 101.265 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -95.18 -14.07 24.44 Favored 'General case' 0 N--CA 1.438 -1.04 0 C-N-CA 129.002 2.921 . . . . 0.0 110.064 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -152.95 20.3 0.76 Allowed Glycine 0 C--N 1.351 1.394 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -122.1 -91.09 0.56 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 101.751 -3.425 . . . . 0.0 101.751 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.63 61.25 0.28 Allowed 'General case' 0 C--N 1.357 0.909 0 C-N-CA 128.909 2.883 . . . . 0.0 105.782 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -110.85 -54.23 2.62 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.552 -1.204 . . . . 0.0 111.891 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 145.61 44.3 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 126.039 1.736 . . . . 0.0 115.209 -171.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.5 mm -96.64 135.14 31.75 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 N-CA-C 103.446 -2.798 . . . . 0.0 103.446 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' HA ' ' A' ' 58' ' ' ARG . 1.0 OUTLIER -109.5 117.58 54.84 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.971 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 -177.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -148.89 -162.83 1.64 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -61.16 -14.61 26.18 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 127.312 2.245 . . . . 0.0 116.209 -174.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 46.7 mm -121.76 -53.52 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 C-N-CA 124.995 1.318 . . . . 0.0 110.548 -173.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -75.93 -0.14 20.39 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.806 2.042 . . . . 0.0 114.933 -171.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.324 0.0 OUTLIER -75.45 -13.52 60.39 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.453 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -81.99 -13.53 57.3 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 126.466 1.907 . . . . 0.0 110.359 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -85.54 -28.0 25.2 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.01 1.724 . . . . 0.0 109.119 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.7 t -163.04 124.47 1.55 Allowed Pre-proline 0 C--N 1.361 1.089 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -101.85 24.56 0.14 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 124.031 3.154 . . . . 0.0 111.043 168.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.95 -49.46 4.12 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.113 1.765 . . . . 0.0 108.199 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 68.8 m -57.07 -34.0 67.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 127.845 2.458 . . . . 0.0 114.128 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.467 ' HA ' HG21 ' A' ' 46' ' ' ILE . 10.9 mtm180 -60.6 -32.14 71.27 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 127.372 2.269 . . . . 0.0 112.515 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -75.66 -38.44 58.79 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.16 -36.39 74.67 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.121 1.768 . . . . 0.0 111.78 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -71.68 -48.84 44.72 Favored 'General case' 0 CA--C 1.499 -0.987 0 C-N-CA 128.293 2.637 . . . . 0.0 111.843 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.458 ' HB2' ' HG3' ' A' ' 67' ' ' MET . 13.6 p -63.76 -34.51 78.05 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 126.554 1.942 . . . . 0.0 111.69 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.6 mt -69.64 -38.9 77.33 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 126.359 1.864 . . . . 0.0 110.515 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.68 -32.56 73.96 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 125.316 1.446 . . . . 0.0 110.737 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.41 ' HB1' HG11 ' A' ' 16' ' ' VAL . . . -66.79 -34.32 77.57 Favored 'General case' 0 C--N 1.359 0.978 0 C-N-CA 127.317 2.247 . . . . 0.0 111.728 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 120.85 22.63 2.94 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 125.061 1.315 . . . . 0.0 112.532 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.458 ' HG3' ' HB2' ' A' ' 62' ' ' CYS . 70.2 mmm -67.71 143.07 56.1 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-N 118.569 1.184 . . . . 0.0 110.252 -177.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' A' ' 14' ' ' TYR . 15.9 t-20 -164.64 128.47 2.49 Favored 'General case' 0 CA--C 1.485 -1.549 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.7 tp -87.8 17.17 4.99 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 127.316 2.246 . . . . 0.0 109.712 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -158.02 62.43 0.46 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 101.815 -3.402 . . . . 0.0 101.815 176.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.26 -131.7 0.29 Allowed 'General case' 0 C--N 1.353 0.719 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 47.5 ttp85 . . . . . 0 C--O 1.26 1.658 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 95.0 mt . . . . . 0 CA--C 1.499 -0.986 0 CA-C-O 120.759 0.314 . . . . 0.0 110.304 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 7' ' ' ASP . 50.8 t -66.94 128.76 37.54 Favored 'General case' 0 C--N 1.372 1.577 0 C-N-CA 129.409 3.083 . . . . 0.0 102.869 177.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.8 mt -102.27 20.66 16.4 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-O 122.466 1.127 . . . . 0.0 111.376 -174.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -120.21 -70.07 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.431 0 C-N-CA 125.905 1.682 . . . . 0.0 108.959 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.1 p -105.63 24.48 12.16 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -175.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 39.08 54.83 2.13 Favored 'General case' 0 C--N 1.362 1.119 0 C-N-CA 127.541 2.336 . . . . 0.0 116.446 166.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.489 ' H ' ' HB3' ' A' ' 2' ' ' CYS . 36.0 t70 -124.11 172.73 8.79 Favored 'General case' 0 CA--C 1.499 -1.004 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.07 113.37 6.38 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.172 1.389 . . . . 0.0 108.717 176.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.491 ' HB1' ' O ' ' A' ' 18' ' ' THR . . . -81.12 144.16 31.89 Favored 'General case' 0 C--N 1.363 1.166 0 CA-C-O 121.517 0.675 . . . . 0.0 109.982 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 79.7 p -84.45 -35.37 23.06 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 125.444 1.497 . . . . 0.0 109.75 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.52 162.41 21.72 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 105.674 -2.97 . . . . 0.0 105.674 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.6 p -80.87 149.29 29.55 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.879 1.272 . . . . 0.0 109.817 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.56 138.19 11.88 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 104.386 -2.45 . . . . 0.0 104.386 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 68' ' ' ASN 0.334 19.9 m-85 82.17 -115.14 0.01 OUTLIER 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.646 -2.724 . . . . 0.0 103.646 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -103.24 -16.82 19.75 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-O 118.046 -1.419 . . . . 0.0 115.497 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.442 HG23 ' HA ' ' A' ' 67' ' ' MET . 11.5 t -141.93 163.97 18.99 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-N 120.368 2.084 . . . . 0.0 110.429 -167.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.6 tp -74.0 104.26 4.78 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.777 2.831 . . . . 0.0 106.466 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.491 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -129.78 174.95 9.24 Favored 'General case' 0 CA--C 1.484 -1.562 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 -175.026 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 2' ' ' CYS . 28.1 p -80.52 -159.02 0.21 Allowed 'General case' 0 C--N 1.36 1.057 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.01 -42.05 8.31 Favored Glycine 0 C--N 1.353 1.52 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 m -74.01 -35.78 64.41 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 125.879 1.671 . . . . 0.0 114.127 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . 0.253 64.0 m -68.94 -20.38 64.21 Favored 'General case' 0 C--N 1.373 1.612 0 C-N-CA 125.575 1.55 . . . . 0.0 112.658 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -64.52 -65.38 0.68 Allowed 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 127.714 2.406 . . . . 0.0 108.595 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -60.87 -37.75 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 C-N-CA 128.623 2.769 . . . . 0.0 113.303 -176.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -56.7 -55.03 39.29 Favored 'General case' 0 CA--C 1.496 -1.115 0 C-N-CA 129.742 3.217 . . . . 0.0 110.315 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.616 ' O ' HG23 ' A' ' 30' ' ' VAL . 70.7 t80 -64.84 -41.57 95.61 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.805 2.442 . . . . 0.0 112.093 -175.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.286 40.1 ttpt -69.02 -27.29 65.54 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.163 0.985 . . . . 0.0 110.995 -178.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -79.66 -43.4 22.85 Favored 'General case' 0 C--N 1.365 1.272 0 C-N-CA 125.81 1.644 . . . . 0.0 109.743 174.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -14.24 62.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 129.161 2.984 . . . . 0.0 114.643 -174.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 26' ' ' PHE . 77.4 t -104.37 -69.24 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 C-N-CA 125.192 1.397 . . . . 0.0 107.337 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -98.44 60.32 1.35 Allowed 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.996 1.718 . . . . 0.0 109.327 -174.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.97 -155.78 9.65 Favored Glycine 0 CA--C 1.494 -1.262 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.57 141.55 49.17 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 155.01 51.02 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -172.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -146.58 70.0 1.2 Allowed 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -119.98 138.7 53.33 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 103.919 -2.622 . . . . 0.0 103.919 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -122.22 115.31 22.15 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-O 121.666 0.746 . . . . 0.0 112.761 -174.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.3 m -175.22 52.72 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 101.265 -3.606 . . . . 0.0 101.265 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -95.18 -14.07 24.44 Favored 'General case' 0 N--CA 1.438 -1.04 0 C-N-CA 129.002 2.921 . . . . 0.0 110.064 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -152.95 20.3 0.76 Allowed Glycine 0 C--N 1.351 1.394 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -122.1 -91.09 0.56 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 101.751 -3.425 . . . . 0.0 101.751 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.63 61.25 0.28 Allowed 'General case' 0 C--N 1.357 0.909 0 C-N-CA 128.909 2.883 . . . . 0.0 105.782 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -110.85 -54.23 2.62 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.552 -1.204 . . . . 0.0 111.891 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 145.61 44.3 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 126.039 1.736 . . . . 0.0 115.209 -171.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.5 mm -96.64 135.14 31.75 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 N-CA-C 103.446 -2.798 . . . . 0.0 103.446 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' HA ' ' A' ' 58' ' ' ARG . 1.0 OUTLIER -109.5 117.58 54.84 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.971 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 -177.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -148.89 -162.83 1.64 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -61.16 -14.61 26.18 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 127.312 2.245 . . . . 0.0 116.209 -174.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 46.7 mm -121.76 -53.52 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 C-N-CA 124.995 1.318 . . . . 0.0 110.548 -173.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -75.93 -0.14 20.39 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.806 2.042 . . . . 0.0 114.933 -171.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.324 0.0 OUTLIER -75.45 -13.52 60.39 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -81.99 -13.53 57.3 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 126.466 1.907 . . . . 0.0 110.359 178.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -85.54 -28.0 25.2 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.01 1.724 . . . . 0.0 109.119 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.7 t -163.04 124.47 1.55 Allowed Pre-proline 0 C--N 1.361 1.089 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -101.85 24.56 0.14 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 124.031 3.154 . . . . 0.0 111.043 168.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.95 -49.46 4.12 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.113 1.765 . . . . 0.0 108.199 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 68.8 m -57.07 -34.0 67.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 127.845 2.458 . . . . 0.0 114.128 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.467 ' HA ' HG21 ' A' ' 46' ' ' ILE . 10.9 mtm180 -60.6 -32.14 71.27 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 127.372 2.269 . . . . 0.0 112.515 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -75.66 -38.44 58.79 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.16 -36.39 74.67 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.121 1.768 . . . . 0.0 111.78 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -71.68 -48.84 44.72 Favored 'General case' 0 CA--C 1.499 -0.987 0 C-N-CA 128.293 2.637 . . . . 0.0 111.843 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.458 ' HB2' ' HG3' ' A' ' 67' ' ' MET . 13.6 p -63.76 -34.51 78.05 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 126.554 1.942 . . . . 0.0 111.69 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.6 mt -69.64 -38.9 77.33 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 126.359 1.864 . . . . 0.0 110.515 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.68 -32.56 73.96 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 125.316 1.446 . . . . 0.0 110.737 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.41 ' HB1' HG11 ' A' ' 16' ' ' VAL . . . -66.79 -34.32 77.57 Favored 'General case' 0 C--N 1.359 0.978 0 C-N-CA 127.317 2.247 . . . . 0.0 111.728 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 120.85 22.63 2.94 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 125.061 1.315 . . . . 0.0 112.532 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.458 ' HG3' ' HB2' ' A' ' 62' ' ' CYS . 70.2 mmm -67.71 143.07 56.1 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-N 118.569 1.184 . . . . 0.0 110.252 -177.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -164.64 128.47 2.49 Favored 'General case' 0 CA--C 1.485 -1.549 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.7 tp -87.8 17.17 4.99 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 127.316 2.246 . . . . 0.0 109.712 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -158.02 62.43 0.46 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 101.815 -3.402 . . . . 0.0 101.815 176.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.26 -131.7 0.29 Allowed 'General case' 0 C--N 1.353 0.719 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 47.5 ttp85 . . . . . 0 C--O 1.26 1.658 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.525 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_