data_4hv2_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 4hv2 _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 80.9 tttt . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 121.294 0.569 . . . . 12.81 111.432 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.68 109.07 22.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-N 114.293 -1.321 . . . . 6.2 108.631 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -71.55 152.66 42.77 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-O 121.884 0.849 . . . . 7.98 112.372 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.28 153.55 32.22 Favored Glycine 0 C--O 1.244 0.773 0 N-CA-C 106.212 -2.755 . . . . 8.96 106.212 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 ttp85 -43.72 -53.21 6.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.965 1.469 . . . . 11.76 114.965 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.2 m -81.72 -33.06 31.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.869 1.267 . . . . 15.31 111.428 -174.01 -70.333 -62.798 -69.86 101.991 2.029 103.489 -67.584 -44.782 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.65 -42.44 88.38 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 114.7 -1.136 . . . . 15.7 111.816 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp -71.34 -40.0 70.99 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.094 0.776 . . . . 8.95 113.094 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.3 -59.68 4.12 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 118.97 -0.538 . . . . 9.16 110.514 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.61 -44.74 37.4 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.025 2.231 . . . . 10.57 117.025 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.36 -37.75 83.72 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.963 0.727 . . . . 9.93 112.963 173.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.9 mtt -69.35 -43.49 73.51 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.387 0.884 . . . . 11.04 113.387 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.34 -45.9 90.09 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.821 -0.627 . . . . 21.03 112.14 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -62.91 -23.54 67.42 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.878 1.066 . . . . 22.73 113.878 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . 0.585 ' O ' ' NZ ' ' A' ' 96' ' ' LYS . 75.6 m-70 -93.28 6.94 46.35 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 113.539 0.94 . . . . 15.65 113.539 176.335 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.0 21.52 55.22 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 118.24 2.056 . . . . 12.94 118.24 173.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mt -81.14 -21.2 39.96 Favored 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 116.759 2.133 . . . . 12.98 116.759 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -66.33 111.34 3.45 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.039 -0.726 . . . . 17.11 109.039 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.22 28.68 17.16 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.165 1.543 . . . . 12.34 115.165 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.68 114.05 6.71 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.647 0.61 . . . . 7.07 112.647 169.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH2' ' O ' ' A' ' 218' ' ' HOH . 8.3 mmm180 60.04 29.81 19.34 Favored 'General case' 0 C--O 1.257 1.47 0 C-N-CA 124.768 1.227 . . . . 23.62 110.097 -176.041 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.92 10.4 62.86 Favored Glycine 0 N--CA 1.465 0.582 0 N-CA-C 118.196 2.038 . . . . 4.14 118.196 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -108.07 106.58 16.86 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 117.716 0.758 . . . . 3.46 111.933 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -54.98 166.53 0.5 Allowed 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.798 -0.816 . . . . 5.36 108.798 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.54 -35.71 76.68 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.522 0.934 . . . . 5.09 113.522 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.51 -26.55 62.26 Favored Glycine 0 N--CA 1.45 -0.403 0 O-C-N 121.69 -0.631 . . . . 4.29 112.743 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -67.82 -43.19 80.16 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.744 1.016 . . . . 3.9 113.744 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.78 -31.16 56.84 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 116.142 -0.481 . . . . 3.21 110.896 -172.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.59 -45.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 123.933 0.893 . . . . 3.7 109.017 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 34.8 t -55.43 -45.27 76.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.819 1.648 . . . . 10.42 112.162 169.937 -171.016 -91.342 -95.97 107.227 2.07 103.37 -84.787 -56.266 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.16 93.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 120.579 -0.448 . . . . 4.6 111.352 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.47 -36.29 65.81 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.892 0.377 . . . . 3.71 111.963 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -50.9 -49.52 59.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 123.784 0.834 . . . . 5.62 112.72 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -92.66 -18.8 22.56 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 115.782 1.771 . . . . 5.15 115.782 -176.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -75.9 -50.71 14.24 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 109.903 -0.406 . . . . 6.31 109.903 173.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -128.28 -10.98 5.22 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.237 1.94 . . . . 6.35 116.237 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.0 t30 60.47 39.34 18.41 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.489 0.661 . . . . 10.09 112.226 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 67.4 18.69 10.14 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.731 -1.577 . . . . 6.48 114.876 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 60.6 t-20 -99.27 119.35 37.77 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 123.212 0.605 . . . . 6.04 110.736 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 47.7 p -68.3 -24.48 64.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.265 0.469 . . . . 5.29 112.265 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -93.11 10.25 32.42 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.871 1.434 . . . . 11.45 114.871 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.46 131.35 45.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.278 0.561 . . . . 7.24 112.438 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.2 p -130.39 145.78 51.86 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.338 1.055 . . . . 10.75 109.895 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -144.41 128.08 17.17 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.897 -0.502 . . . . 20.45 111.531 171.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -72.14 130.69 41.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.491 -0.322 . . . . 22.01 110.595 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -94.12 160.82 14.53 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.392 -0.966 . . . . 25.36 108.392 175.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.7 p -63.14 -40.66 98.23 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 123.708 0.63 . . . . 22.04 112.655 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -67.32 9.17 0.24 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.705 1.202 . . . . 23.04 113.56 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.96 -5.65 70.02 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 117.956 1.943 . . . . 16.2 117.956 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.9 p -81.92 160.03 23.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.229 -1.397 . . . . 12.47 107.229 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.5 m -116.64 144.57 44.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.281 0.363 . . . . 9.31 110.538 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -95.46 134.96 37.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 123.587 0.755 . . . . 13.85 109.21 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -122.96 128.28 50.02 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 118.73 2.863 . . . . 11.96 118.73 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.24 -163.79 37.89 Favored Glycine 0 N--CA 1.432 -1.585 0 N-CA-C 118.401 2.12 . . . . 5.61 118.401 165.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.51 -35.64 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 C-N-CA 125.922 1.689 . . . . 8.87 111.98 -175.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.6 16.69 19.64 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.81 0.814 . . . . 4.88 112.032 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 47.94 58.78 4.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.791 1.404 . . . . 5.5 114.791 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 15.2 mt -84.78 129.18 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 122.675 1.226 . . . . 7.52 114.287 -175.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -78.45 138.9 38.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.412 -1.722 . . . . 18.22 114.489 -166.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -77.94 -13.7 59.79 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.782 1.401 . . . . 10.04 114.782 -179.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -67.38 -39.07 85.61 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 113.581 0.956 . . . . 22.79 113.581 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -111.75 -35.77 5.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.611 0.597 . . . . 19.82 112.611 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -105.29 -26.69 11.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 118.246 2.684 . . . . 7.01 118.246 -155.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.4 p -143.71 160.25 41.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.895 0.378 . . . . 8.29 111.522 -179.648 62.33 85.378 93.234 102.781 2.059 106.635 -58.726 -64.971 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -96.31 123.08 39.83 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 113.881 1.067 . . . . 10.07 113.881 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -120.87 6.76 10.39 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.429 1.27 . . . . 6.98 114.429 169.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.65 2.29 27.89 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 116.38 1.312 . . . . 10.72 116.38 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -136.45 32.31 2.81 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 114.978 1.473 . . . . 24.26 114.978 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 m -126.72 80.69 70.08 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 116.295 -0.411 . . . . 9.5 110.56 173.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.31 125.45 7.26 Favored 'Trans proline' 0 C--N 1.354 0.826 0 N-CA-C 115.343 1.247 . . . . 10.43 115.343 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.63 27.65 50.26 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 115.441 0.937 . . . . 10.8 115.441 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 80.5 p -106.51 176.23 5.24 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 108.96 -0.756 . . . . 8.88 108.96 -172.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.1 mmm-85 -115.84 173.57 6.49 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.085 -0.961 . . . . 20.17 109.714 -178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -137.29 73.41 1.44 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.729 -1.582 . . . . 10.69 106.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . 0.552 ' O ' ' NZ ' ' A' ' 97' ' ' LYS . 72.0 mt -73.23 -19.54 61.06 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.219 1.563 . . . . 9.33 115.219 -177.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.7 m -95.56 -3.38 46.61 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 118.213 0.46 . . . . 10.54 109.838 179.166 -76.027 174.815 84.387 104.28 2.05 105.419 54.621 -169.174 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.59 50.57 14.22 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.597 1.559 . . . . 16.36 113.991 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 6.0 pt -141.14 147.16 46.23 Favored Pre-proline 0 N--CA 1.453 -0.316 0 CA-C-N 116.404 -0.362 . . . . 9.0 110.832 -172.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -71.32 131.8 19.7 Favored 'Trans proline' 0 CA--C 1.501 -1.138 0 N-CA-C 107.941 -1.6 . . . . 9.43 107.941 166.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 92.4 m -48.9 -29.87 5.22 Favored 'General case' 0 C--O 1.211 -0.962 0 N-CA-C 113.991 1.108 . . . . 11.58 113.991 -177.806 -64.971 -58.726 93.234 106.635 2.059 102.781 85.378 62.33 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -53.0 -29.09 27.19 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 115.361 1.615 . . . . 13.79 115.361 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.36 -25.2 64.96 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.999 -0.546 . . . . 6.92 110.678 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.4 mt -72.51 -3.93 27.4 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 114.235 1.198 . . . . 6.54 114.235 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -109.21 -5.57 15.88 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 114.809 1.411 . . . . 9.37 114.809 -175.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.4 p -68.39 165.36 18.93 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 113.101 0.778 . . . . 14.22 113.101 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -74.31 -26.46 60.18 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.314 -0.857 . . . . 14.15 111.768 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -73.74 113.07 10.46 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 114.98 -1.009 . . . . 16.13 110.34 164.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 24.6 pt -83.48 7.76 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 114.893 1.442 . . . . 11.24 114.893 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 92.7 m -54.62 -46.18 73.81 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.221 1.563 . . . . 11.0 115.221 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.77 81.79 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 111.888 0.329 . . . . 10.49 111.888 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -61.71 -48.5 80.46 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 111.801 0.297 . . . . 10.61 111.801 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 83.8 t -57.85 -52.88 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 123.772 0.67 . . . . 9.41 112.398 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -59.69 -37.71 79.58 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.483 0.549 . . . . 14.87 112.483 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.7 t -72.94 -33.14 65.74 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.463 0.912 . . . . 12.58 113.463 175.546 -169.174 54.621 84.387 105.419 2.05 104.28 174.815 -76.027 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.21 92.31 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.217 0.821 . . . . 8.62 113.217 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 15' ' ' HIS . 26.1 mttt -58.8 -40.71 84.88 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.583 -0.735 . . . . 10.08 110.292 179.089 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.552 ' NZ ' ' O ' ' A' ' 75' ' ' LEU . 55.1 tttt -68.52 -41.49 79.87 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.727 1.251 . . . . 23.46 113.653 178.225 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.07 -54.96 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-N 114.054 -1.43 . . . . 10.01 108.465 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -57.24 -19.97 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.333 1.235 . . . . 7.94 114.333 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -93.85 -2.32 53.61 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.935 1.087 . . . . 10.74 113.935 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -77.02 -3.22 37.96 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.291 1.219 . . . . 18.74 114.291 -172.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.98 -24.4 6.35 Favored Glycine 0 C--O 1.22 -0.736 0 N-CA-C 116.542 1.377 . . . . 12.54 116.542 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -106.0 9.05 32.66 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.606 1.706 . . . . 13.2 115.606 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 65.77 -142.27 43.36 Favored Glycine 0 N--CA 1.465 0.621 0 N-CA-C 110.55 -1.02 . . . . 7.79 110.55 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.4 mtp -81.93 -0.96 46.26 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-O 121.243 0.544 . . . . 5.51 112.213 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.29 -22.0 66.8 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 123.736 0.814 . . . . 7.03 111.357 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.83 -32.98 15.42 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 123.715 0.634 . . . . 8.62 112.051 168.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.6 m-90 -92.06 103.57 16.06 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.142 -1.058 . . . . 9.63 108.142 174.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.85 -31.15 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 N-CA-C 113.699 1.0 . . . . 10.27 113.699 179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.24 84.62 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.796 0.665 . . . . 8.9 112.796 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -65.9 -44.25 85.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.306 0.574 . . . . 9.34 110.669 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -36.64 79.96 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.848 -0.614 . . . . 34.48 109.871 -175.133 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -89.71 -14.1 35.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 114.473 1.286 . . . . 11.12 114.473 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -131.44 -20.37 2.65 Favored 'General case' 0 CA--C 1.561 1.397 0 N-CA-C 116.967 2.21 . . . . 8.57 116.967 -174.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 61.4 m -116.45 -44.98 2.83 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.732 0.641 . . . . 9.3 112.732 -175.625 -56.266 -84.787 -95.97 103.37 2.07 107.227 -91.342 -171.016 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -50.29 121.32 5.43 Favored 'General case' 0 C--O 1.252 1.208 0 O-C-N 123.766 0.666 . . . . 12.62 110.974 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 86.15 -3.41 87.12 Favored Glycine 0 N--CA 1.465 0.621 0 CA-C-N 114.492 -1.231 . . . . 14.23 114.822 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.1 p -91.36 173.89 7.67 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 117.546 0.673 . . . . 13.55 111.015 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -85.55 82.85 8.1 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.652 1.215 . . . . 23.41 107.947 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.9 m -70.79 -32.39 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 114.184 -1.371 . . . . 15.79 113.592 -177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -49.49 -20.86 0.8 Allowed 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.733 1.012 . . . . 31.08 113.733 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . 0.672 ' O ' ' CG ' ' A' ' 125' ' ' ARG . . . -64.77 -26.81 68.52 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.943 -0.571 . . . . 17.15 110.763 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -68.77 -21.99 64.32 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 113.447 0.906 . . . . 16.56 113.447 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 20.9 pt -101.44 1.94 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 N-CA-C 115.035 1.494 . . . . 18.15 115.035 171.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . 0.672 ' CG ' ' O ' ' A' ' 122' ' ' ALA . 1.5 ptt85 -46.92 114.22 0.8 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.125 0.97 . . . . 37.07 113.362 173.018 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.07 18.9 60.12 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 117.662 1.825 . . . . 20.35 117.662 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 9.8 m -105.63 137.63 43.15 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 118.364 1.082 . . . . 21.1 112.834 -178.406 -44.782 -67.584 -69.86 103.489 2.029 101.991 -62.798 -70.333 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 -75.21 111.34 10.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.305 -0.998 . . . . 31.19 108.305 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.864 0.84 . . . . 25.43 111.734 -177.881 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . 0.446 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . 0.543 ' O ' ' NH1' ' A' ' 125' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 80.9 tttt . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 121.294 0.569 . . . . 12.81 111.432 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.68 109.07 22.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-N 114.293 -1.321 . . . . 6.2 108.631 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -71.55 152.66 42.77 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-O 121.884 0.849 . . . . 7.98 112.372 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.28 153.55 32.22 Favored Glycine 0 C--O 1.244 0.773 0 N-CA-C 106.212 -2.755 . . . . 8.96 106.212 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 ttp85 -43.72 -53.21 6.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.965 1.469 . . . . 11.76 114.965 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.2 m -81.72 -33.06 31.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.869 1.267 . . . . 15.31 111.428 -174.01 -70.333 -62.798 -69.86 101.991 2.029 103.489 -67.584 -44.782 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.65 -42.44 88.38 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 114.7 -1.136 . . . . 15.7 111.816 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp -71.34 -40.0 70.99 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.094 0.776 . . . . 8.95 113.094 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.3 -59.68 4.12 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 118.97 -0.538 . . . . 9.16 110.514 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.61 -44.74 37.4 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.025 2.231 . . . . 10.57 117.025 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.36 -37.75 83.72 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.963 0.727 . . . . 9.93 112.963 173.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.9 mtt -69.35 -43.49 73.51 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.387 0.884 . . . . 11.04 113.387 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.34 -45.9 90.09 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.821 -0.627 . . . . 21.03 112.14 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -62.91 -23.54 67.42 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.878 1.066 . . . . 22.73 113.878 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.57 ' O ' ' NZ ' ' A' ' 96' ' ' LYS . 74.8 m80 -93.28 6.94 46.35 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 113.539 0.94 . . . . 15.65 113.539 176.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.0 21.52 55.22 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 118.24 2.056 . . . . 12.94 118.24 173.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mt -81.14 -21.2 39.96 Favored 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 116.759 2.133 . . . . 12.98 116.759 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -66.33 111.34 3.45 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.039 -0.726 . . . . 17.11 109.039 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.22 28.68 17.16 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.165 1.543 . . . . 12.34 115.165 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.68 114.05 6.71 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.647 0.61 . . . . 7.07 112.647 169.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 60.04 29.81 19.34 Favored 'General case' 0 C--O 1.257 1.47 0 C-N-CA 124.768 1.227 . . . . 23.62 110.097 -176.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.92 10.4 62.86 Favored Glycine 0 N--CA 1.465 0.582 0 N-CA-C 118.196 2.038 . . . . 4.14 118.196 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -108.07 106.58 16.86 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 117.716 0.758 . . . . 3.46 111.933 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -54.98 166.53 0.5 Allowed 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.798 -0.816 . . . . 5.36 108.798 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.54 -35.71 76.68 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.522 0.934 . . . . 5.09 113.522 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.51 -26.55 62.26 Favored Glycine 0 N--CA 1.45 -0.403 0 O-C-N 121.69 -0.631 . . . . 4.29 112.743 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -67.82 -43.19 80.16 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.744 1.016 . . . . 3.9 113.744 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.78 -31.16 56.84 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 116.142 -0.481 . . . . 3.21 110.896 -172.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.59 -45.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 123.933 0.893 . . . . 3.7 109.017 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 34.8 t -55.43 -45.27 76.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.819 1.648 . . . . 10.42 112.162 169.937 -171.016 -91.342 -95.97 107.227 2.07 103.37 -84.787 -56.266 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.16 93.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 120.579 -0.448 . . . . 4.6 111.352 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.47 -36.29 65.81 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.892 0.377 . . . . 3.71 111.963 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HG2' ' CH2' ' A' ' 123' ' ' TRP . 50.4 tptt -50.9 -49.52 59.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 123.784 0.834 . . . . 5.62 112.72 176.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -92.66 -18.8 22.56 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 115.782 1.771 . . . . 5.15 115.782 -176.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -75.9 -50.71 14.24 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 109.903 -0.406 . . . . 6.31 109.903 173.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -128.28 -10.98 5.22 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.237 1.94 . . . . 6.35 116.237 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.0 t30 60.47 39.34 18.41 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.489 0.661 . . . . 10.09 112.226 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 67.4 18.69 10.14 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.731 -1.577 . . . . 6.48 114.876 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 60.6 t-20 -99.27 119.35 37.77 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 123.212 0.605 . . . . 6.04 110.736 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 47.7 p -68.3 -24.48 64.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.265 0.469 . . . . 5.29 112.265 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -93.11 10.25 32.42 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.871 1.434 . . . . 11.45 114.871 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.46 131.35 45.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.278 0.561 . . . . 7.24 112.438 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.2 p -130.39 145.78 51.86 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.338 1.055 . . . . 10.75 109.895 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 0.747 ' HB3' ' O ' ' A' ' 241' ' ' HOH . 57.4 m-80 -144.41 128.08 17.17 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.897 -0.502 . . . . 20.45 111.531 171.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -72.14 130.69 41.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.491 -0.322 . . . . 22.01 110.595 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -94.12 160.82 14.53 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.392 -0.966 . . . . 25.36 108.392 175.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.7 p -63.14 -40.66 98.23 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 123.708 0.63 . . . . 22.04 112.655 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -67.32 9.17 0.24 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.705 1.202 . . . . 23.04 113.56 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.96 -5.65 70.02 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 117.956 1.943 . . . . 16.2 117.956 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.9 p -81.92 160.03 23.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.229 -1.397 . . . . 12.47 107.229 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.5 m -116.64 144.57 44.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.281 0.363 . . . . 9.31 110.538 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -95.46 134.96 37.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 123.587 0.755 . . . . 13.85 109.21 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -122.96 128.28 50.02 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 118.73 2.863 . . . . 11.96 118.73 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.24 -163.79 37.89 Favored Glycine 0 N--CA 1.432 -1.585 0 N-CA-C 118.401 2.12 . . . . 5.61 118.401 165.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.51 -35.64 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 C-N-CA 125.922 1.689 . . . . 8.87 111.98 -175.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.6 16.69 19.64 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.81 0.814 . . . . 4.88 112.032 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 47.94 58.78 4.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.791 1.404 . . . . 5.5 114.791 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 15.2 mt -84.78 129.18 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 122.675 1.226 . . . . 7.52 114.287 -175.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -78.45 138.9 38.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.412 -1.722 . . . . 18.22 114.489 -166.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -77.94 -13.7 59.79 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.782 1.401 . . . . 10.04 114.782 -179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.804 ' HG3' HH11 ' A' ' 61' ' ' ARG . 1.8 ttm-85 -67.38 -39.07 85.61 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 113.581 0.956 . . . . 22.79 113.581 -179.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . 0.487 ' HD1' ' HG2' ' A' ' 61' ' ' ARG . 12.8 m0 -111.75 -35.77 5.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.611 0.597 . . . . 19.82 112.611 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 72.7 m95 -105.29 -26.69 11.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 118.246 2.684 . . . . 7.01 118.246 -155.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.4 p -143.71 160.25 41.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.895 0.378 . . . . 8.29 111.522 -179.648 62.33 85.378 93.234 102.781 2.059 106.635 -58.726 -64.971 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -96.31 123.08 39.83 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 113.881 1.067 . . . . 10.07 113.881 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -120.87 6.76 10.39 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.429 1.27 . . . . 6.98 114.429 169.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.65 2.29 27.89 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 116.38 1.312 . . . . 10.72 116.38 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -136.45 32.31 2.81 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 114.978 1.473 . . . . 24.26 114.978 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 m -126.72 80.69 70.08 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 116.295 -0.411 . . . . 9.5 110.56 173.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.31 125.45 7.26 Favored 'Trans proline' 0 C--N 1.354 0.826 0 N-CA-C 115.343 1.247 . . . . 10.43 115.343 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.63 27.65 50.26 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 115.441 0.937 . . . . 10.8 115.441 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 80.5 p -106.51 176.23 5.24 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 108.96 -0.756 . . . . 8.88 108.96 -172.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.1 mmm-85 -115.84 173.57 6.49 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.085 -0.961 . . . . 20.17 109.714 -178.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -137.29 73.41 1.44 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.729 -1.582 . . . . 10.69 106.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 72.0 mt -73.23 -19.54 61.06 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.219 1.563 . . . . 9.33 115.219 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 63' ' ' TRP . 52.7 m -95.56 -3.38 46.61 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 118.213 0.46 . . . . 10.54 109.838 179.166 -76.027 174.815 84.387 104.28 2.05 105.419 54.621 -169.174 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.59 50.57 14.22 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.597 1.559 . . . . 16.36 113.991 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 6.0 pt -141.14 147.16 46.23 Favored Pre-proline 0 N--CA 1.453 -0.316 0 CA-C-N 116.404 -0.362 . . . . 9.0 110.832 -172.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -71.32 131.8 19.7 Favored 'Trans proline' 0 CA--C 1.501 -1.138 0 N-CA-C 107.941 -1.6 . . . . 9.43 107.941 166.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 92.4 m -48.9 -29.87 5.22 Favored 'General case' 0 C--O 1.211 -0.962 0 N-CA-C 113.991 1.108 . . . . 11.58 113.991 -177.806 -64.971 -58.726 93.234 106.635 2.059 102.781 85.378 62.33 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -53.0 -29.09 27.19 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 115.361 1.615 . . . . 13.79 115.361 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.36 -25.2 64.96 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.999 -0.546 . . . . 6.92 110.678 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.4 mt -72.51 -3.93 27.4 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 114.235 1.198 . . . . 6.54 114.235 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -109.21 -5.57 15.88 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 114.809 1.411 . . . . 9.37 114.809 -175.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.4 p -68.39 165.36 18.93 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 113.101 0.778 . . . . 14.22 113.101 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -74.31 -26.46 60.18 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.314 -0.857 . . . . 14.15 111.768 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -73.74 113.07 10.46 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 114.98 -1.009 . . . . 16.13 110.34 164.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 24.6 pt -83.48 7.76 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 114.893 1.442 . . . . 11.24 114.893 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 92.7 m -54.62 -46.18 73.81 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.221 1.563 . . . . 11.0 115.221 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.77 81.79 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 111.888 0.329 . . . . 10.49 111.888 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -61.71 -48.5 80.46 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 111.801 0.297 . . . . 10.61 111.801 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.524 HG11 ' HB3' ' A' ' 15' ' ' HIS . 83.8 t -57.85 -52.88 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 123.772 0.67 . . . . 9.41 112.398 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -59.69 -37.71 79.58 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.483 0.549 . . . . 14.87 112.483 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.7 t -72.94 -33.14 65.74 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.463 0.912 . . . . 12.58 113.463 175.546 -169.174 54.621 84.387 105.419 2.05 104.28 174.815 -76.027 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.21 92.31 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.217 0.821 . . . . 8.62 113.217 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.57 ' NZ ' ' O ' ' A' ' 15' ' ' HIS . 26.1 mttt -58.8 -40.71 84.88 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.583 -0.735 . . . . 10.08 110.292 179.089 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.1 tttt -68.52 -41.49 79.87 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.727 1.251 . . . . 23.46 113.653 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 0.451 HG12 ' CE2' ' A' ' 63' ' ' TRP . 88.0 mt -64.07 -54.96 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-N 114.054 -1.43 . . . . 10.01 108.465 178.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -57.24 -19.97 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.333 1.235 . . . . 7.94 114.333 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -93.85 -2.32 53.61 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.935 1.087 . . . . 10.74 113.935 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -77.02 -3.22 37.96 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.291 1.219 . . . . 18.74 114.291 -172.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.98 -24.4 6.35 Favored Glycine 0 C--O 1.22 -0.736 0 N-CA-C 116.542 1.377 . . . . 12.54 116.542 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -106.0 9.05 32.66 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.606 1.706 . . . . 13.2 115.606 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 65.77 -142.27 43.36 Favored Glycine 0 N--CA 1.465 0.621 0 N-CA-C 110.55 -1.02 . . . . 7.79 110.55 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.4 mtp -81.93 -0.96 46.26 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-O 121.243 0.544 . . . . 5.51 112.213 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.29 -22.0 66.8 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 123.736 0.814 . . . . 7.03 111.357 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.83 -32.98 15.42 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 123.715 0.634 . . . . 8.62 112.051 168.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.6 m-90 -92.06 103.57 16.06 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.142 -1.058 . . . . 9.63 108.142 174.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 113' ' ' ASN . 4.9 t -59.85 -31.15 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 N-CA-C 113.699 1.0 . . . . 10.27 113.699 179.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.24 84.62 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.796 0.665 . . . . 8.9 112.796 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 0.559 ' CD1' ' HB2' ' A' ' 115' ' ' CYS . 84.5 t90 -65.9 -44.25 85.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.306 0.574 . . . . 9.34 110.669 175.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . 0.402 HH21 HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -68.16 -36.64 79.96 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.848 -0.614 . . . . 34.48 109.871 -175.133 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 109' ' ' VAL . 94.3 m-20 -89.71 -14.1 35.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 114.473 1.286 . . . . 11.12 114.473 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -131.44 -20.37 2.65 Favored 'General case' 0 CA--C 1.561 1.397 0 N-CA-C 116.967 2.21 . . . . 8.57 116.967 -174.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . 0.559 ' HB2' ' CD1' ' A' ' 111' ' ' TRP . 61.4 m -116.45 -44.98 2.83 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.732 0.641 . . . . 9.3 112.732 -175.625 -56.266 -84.787 -95.97 103.37 2.07 107.227 -91.342 -171.016 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -50.29 121.32 5.43 Favored 'General case' 0 C--O 1.252 1.208 0 O-C-N 123.766 0.666 . . . . 12.62 110.974 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 86.15 -3.41 87.12 Favored Glycine 0 N--CA 1.465 0.621 0 CA-C-N 114.492 -1.231 . . . . 14.23 114.822 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.1 p -91.36 173.89 7.67 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 117.546 0.673 . . . . 13.55 111.015 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -85.55 82.85 8.1 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.652 1.215 . . . . 23.41 107.947 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.9 m -70.79 -32.39 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 114.184 -1.371 . . . . 15.79 113.592 -177.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -49.49 -20.86 0.8 Allowed 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.733 1.012 . . . . 31.08 113.733 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 1.101 ' O ' ' HG2' ' A' ' 125' ' ' ARG . . . -64.77 -26.81 68.52 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.943 -0.571 . . . . 17.15 110.763 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.494 ' CH2' ' HG2' ' A' ' 33' ' ' LYS . 96.5 m95 -68.77 -21.99 64.32 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 113.447 0.906 . . . . 16.56 113.447 179.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 20.9 pt -101.44 1.94 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 N-CA-C 115.035 1.494 . . . . 18.15 115.035 171.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . 1.101 ' HG2' ' O ' ' A' ' 122' ' ' ALA . 1.5 ptt85 -46.92 114.22 0.8 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.125 0.97 . . . . 37.07 113.362 173.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.07 18.9 60.12 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 117.662 1.825 . . . . 20.35 117.662 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 9.8 m -105.63 137.63 43.15 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 118.364 1.082 . . . . 21.1 112.834 -178.406 -44.782 -67.584 -69.86 103.489 2.029 101.991 -62.798 -70.333 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 -75.21 111.34 10.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.305 -0.998 . . . . 31.19 108.305 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.864 0.84 . . . . 25.43 111.734 -177.881 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . 0.747 ' O ' ' HB3' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 80.9 tttt . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 121.294 0.569 . . . . 12.81 111.432 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.68 109.07 22.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-N 114.293 -1.321 . . . . 6.2 108.631 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -71.55 152.66 42.77 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-O 121.884 0.849 . . . . 7.98 112.372 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.28 153.55 32.22 Favored Glycine 0 C--O 1.244 0.773 0 N-CA-C 106.212 -2.755 . . . . 8.96 106.212 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 ttp85 -43.72 -53.21 6.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.965 1.469 . . . . 11.76 114.965 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.2 m -81.72 -33.06 31.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.869 1.267 . . . . 15.31 111.428 -174.01 -70.333 -62.798 -69.86 101.991 2.029 103.489 -67.584 -44.782 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.65 -42.44 88.38 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 114.7 -1.136 . . . . 15.7 111.816 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp -71.34 -40.0 70.99 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.094 0.776 . . . . 8.95 113.094 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.3 -59.68 4.12 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 118.97 -0.538 . . . . 9.16 110.514 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.61 -44.74 37.4 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.025 2.231 . . . . 10.57 117.025 171.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.496 ' O ' ' HD2' ' A' ' 15' ' ' HIS . . . -67.36 -37.75 83.72 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.963 0.727 . . . . 9.93 112.963 173.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.9 mtt -69.35 -43.49 73.51 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.387 0.884 . . . . 11.04 113.387 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -59.34 -45.9 90.09 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.821 -0.627 . . . . 21.03 112.14 173.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 ttp180 -62.91 -23.54 67.42 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.878 1.066 . . . . 22.73 113.878 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.57 ' O ' ' NZ ' ' A' ' 96' ' ' LYS . 75.6 m-70 -93.28 6.94 46.35 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 113.539 0.94 . . . . 15.65 113.539 176.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.0 21.52 55.22 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 118.24 2.056 . . . . 12.94 118.24 173.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mt -81.14 -21.2 39.96 Favored 'General case' 0 CA--C 1.555 1.153 0 N-CA-C 116.759 2.133 . . . . 12.98 116.759 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -66.33 111.34 3.45 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.039 -0.726 . . . . 17.11 109.039 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.22 28.68 17.16 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.165 1.543 . . . . 12.34 115.165 -172.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -68.68 114.05 6.71 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.647 0.61 . . . . 7.07 112.647 169.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 60.04 29.81 19.34 Favored 'General case' 0 C--O 1.257 1.47 0 C-N-CA 124.768 1.227 . . . . 23.62 110.097 -176.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.92 10.4 62.86 Favored Glycine 0 N--CA 1.465 0.582 0 N-CA-C 118.196 2.038 . . . . 4.14 118.196 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -108.07 106.58 16.86 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 117.716 0.758 . . . . 3.46 111.933 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -54.98 166.53 0.5 Allowed 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.798 -0.816 . . . . 5.36 108.798 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.54 -35.71 76.68 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.522 0.934 . . . . 5.09 113.522 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.51 -26.55 62.26 Favored Glycine 0 N--CA 1.45 -0.403 0 O-C-N 121.69 -0.631 . . . . 4.29 112.743 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -67.82 -43.19 80.16 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.744 1.016 . . . . 3.9 113.744 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -76.78 -31.16 56.84 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-N 116.142 -0.481 . . . . 3.21 110.896 -172.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.59 -45.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 123.933 0.893 . . . . 3.7 109.017 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 34.8 t -55.43 -45.27 76.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.819 1.648 . . . . 10.42 112.162 169.937 -171.016 -91.342 -95.97 107.227 2.07 103.37 -84.787 -56.266 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.06 -42.16 93.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 120.579 -0.448 . . . . 4.6 111.352 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.47 -36.29 65.81 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.892 0.377 . . . . 3.71 111.963 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HG2' ' CH2' ' A' ' 123' ' ' TRP . 50.4 tptt -50.9 -49.52 59.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 123.784 0.834 . . . . 5.62 112.72 176.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -92.66 -18.8 22.56 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 115.782 1.771 . . . . 5.15 115.782 -176.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -75.9 -50.71 14.24 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 109.903 -0.406 . . . . 6.31 109.903 173.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -128.28 -10.98 5.22 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.237 1.94 . . . . 6.35 116.237 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.0 t30 60.47 39.34 18.41 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.489 0.661 . . . . 10.09 112.226 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 67.4 18.69 10.14 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.731 -1.577 . . . . 6.48 114.876 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 60.6 t-20 -99.27 119.35 37.77 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 123.212 0.605 . . . . 6.04 110.736 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 47.7 p -68.3 -24.48 64.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.265 0.469 . . . . 5.29 112.265 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -93.11 10.25 32.42 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.871 1.434 . . . . 11.45 114.871 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.46 131.35 45.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.278 0.561 . . . . 7.24 112.438 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.2 p -130.39 145.78 51.86 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.338 1.055 . . . . 10.75 109.895 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.747 ' HB3' ' O ' ' A' ' 241' ' ' HOH . 57.4 m-80 -144.41 128.08 17.17 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.897 -0.502 . . . . 20.45 111.531 171.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -72.14 130.69 41.48 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.491 -0.322 . . . . 22.01 110.595 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.412 HD21 ' CG ' ' A' ' 52' ' ' ASP . 3.8 m-80 -94.12 160.82 14.53 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.392 -0.966 . . . . 25.36 108.392 175.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.7 p -63.14 -40.66 98.23 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 123.708 0.63 . . . . 22.04 112.655 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -67.32 9.17 0.24 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.705 1.202 . . . . 23.04 113.56 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.96 -5.65 70.02 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 117.956 1.943 . . . . 16.2 117.956 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.9 p -81.92 160.03 23.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.229 -1.397 . . . . 12.47 107.229 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.5 m -116.64 144.57 44.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.281 0.363 . . . . 9.31 110.538 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.412 ' CG ' HD21 ' A' ' 46' ' ' ASN . 82.4 m-20 -95.46 134.96 37.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 123.587 0.755 . . . . 13.85 109.21 174.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -122.96 128.28 50.02 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 118.73 2.863 . . . . 11.96 118.73 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.24 -163.79 37.89 Favored Glycine 0 N--CA 1.432 -1.585 0 N-CA-C 118.401 2.12 . . . . 5.61 118.401 165.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.51 -35.64 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 C-N-CA 125.922 1.689 . . . . 8.87 111.98 -175.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 34.5 mt -112.6 16.69 19.64 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.81 0.814 . . . . 4.88 112.032 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 47.94 58.78 4.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.791 1.404 . . . . 5.5 114.791 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 15.2 mt -84.78 129.18 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 122.675 1.226 . . . . 7.52 114.287 -175.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -78.45 138.9 38.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.412 -1.722 . . . . 18.22 114.489 -166.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -77.94 -13.7 59.79 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.782 1.401 . . . . 10.04 114.782 -179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.804 ' HG3' HH11 ' A' ' 61' ' ' ARG . 1.8 ttm-85 -67.38 -39.07 85.61 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 113.581 0.956 . . . . 22.79 113.581 -179.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.487 ' HD1' ' HG2' ' A' ' 61' ' ' ARG . 12.8 m0 -111.75 -35.77 5.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.611 0.597 . . . . 19.82 112.611 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 72.7 m95 -105.29 -26.69 11.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 118.246 2.684 . . . . 7.01 118.246 -155.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.4 p -143.71 160.25 41.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.895 0.378 . . . . 8.29 111.522 -179.648 62.33 85.378 93.234 102.781 2.059 106.635 -58.726 -64.971 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -96.31 123.08 39.83 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 113.881 1.067 . . . . 10.07 113.881 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -120.87 6.76 10.39 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.429 1.27 . . . . 6.98 114.429 169.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.65 2.29 27.89 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 116.38 1.312 . . . . 10.72 116.38 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -136.45 32.31 2.81 Favored 'General case' 0 C--O 1.251 1.157 0 N-CA-C 114.978 1.473 . . . . 24.26 114.978 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 m -126.72 80.69 70.08 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 116.295 -0.411 . . . . 9.5 110.56 173.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.31 125.45 7.26 Favored 'Trans proline' 0 C--N 1.354 0.826 0 N-CA-C 115.343 1.247 . . . . 10.43 115.343 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.63 27.65 50.26 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 115.441 0.937 . . . . 10.8 115.441 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 80.5 p -106.51 176.23 5.24 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 108.96 -0.756 . . . . 8.88 108.96 -172.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.1 mmm-85 -115.84 173.57 6.49 Favored 'General case' 0 N--CA 1.433 -1.286 0 CA-C-N 115.085 -0.961 . . . . 20.17 109.714 -178.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -137.29 73.41 1.44 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 106.729 -1.582 . . . . 10.69 106.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 72.0 mt -73.23 -19.54 61.06 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.219 1.563 . . . . 9.33 115.219 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 63' ' ' TRP . 52.7 m -95.56 -3.38 46.61 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 118.213 0.46 . . . . 10.54 109.838 179.166 -76.027 174.815 84.387 104.28 2.05 105.419 54.621 -169.174 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.59 50.57 14.22 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.597 1.559 . . . . 16.36 113.991 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 6.0 pt -141.14 147.16 46.23 Favored Pre-proline 0 N--CA 1.453 -0.316 0 CA-C-N 116.404 -0.362 . . . . 9.0 110.832 -172.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -71.32 131.8 19.7 Favored 'Trans proline' 0 CA--C 1.501 -1.138 0 N-CA-C 107.941 -1.6 . . . . 9.43 107.941 166.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 92.4 m -48.9 -29.87 5.22 Favored 'General case' 0 C--O 1.211 -0.962 0 N-CA-C 113.991 1.108 . . . . 11.58 113.991 -177.806 -64.971 -58.726 93.234 106.635 2.059 102.781 85.378 62.33 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -53.0 -29.09 27.19 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 115.361 1.615 . . . . 13.79 115.361 174.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.36 -25.2 64.96 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.999 -0.546 . . . . 6.92 110.678 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.4 mt -72.51 -3.93 27.4 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 114.235 1.198 . . . . 6.54 114.235 175.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -109.21 -5.57 15.88 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 114.809 1.411 . . . . 9.37 114.809 -175.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.4 p -68.39 165.36 18.93 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 113.101 0.778 . . . . 14.22 113.101 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -74.31 -26.46 60.18 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.314 -0.857 . . . . 14.15 111.768 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -73.74 113.07 10.46 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 114.98 -1.009 . . . . 16.13 110.34 164.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 24.6 pt -83.48 7.76 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 114.893 1.442 . . . . 11.24 114.893 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 92.7 m -54.62 -46.18 73.81 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.221 1.563 . . . . 11.0 115.221 -176.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.77 81.79 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 111.888 0.329 . . . . 10.49 111.888 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -61.71 -48.5 80.46 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 111.801 0.297 . . . . 10.61 111.801 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.524 HG11 ' HB3' ' A' ' 15' ' ' HIS . 83.8 t -57.85 -52.88 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 123.772 0.67 . . . . 9.41 112.398 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -59.69 -37.71 79.58 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.483 0.549 . . . . 14.87 112.483 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 23.7 t -72.94 -33.14 65.74 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.463 0.912 . . . . 12.58 113.463 175.546 -169.174 54.621 84.387 105.419 2.05 104.28 174.815 -76.027 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.21 92.31 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.217 0.821 . . . . 8.62 113.217 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.57 ' NZ ' ' O ' ' A' ' 15' ' ' HIS . 26.1 mttt -58.8 -40.71 84.88 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.583 -0.735 . . . . 10.08 110.292 179.089 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.1 tttt -68.52 -41.49 79.87 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.727 1.251 . . . . 23.46 113.653 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.451 HG12 ' CE2' ' A' ' 63' ' ' TRP . 88.0 mt -64.07 -54.96 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-N 114.054 -1.43 . . . . 10.01 108.465 178.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -57.24 -19.97 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.333 1.235 . . . . 7.94 114.333 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -93.85 -2.32 53.61 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.935 1.087 . . . . 10.74 113.935 178.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -77.02 -3.22 37.96 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.291 1.219 . . . . 18.74 114.291 -172.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.98 -24.4 6.35 Favored Glycine 0 C--O 1.22 -0.736 0 N-CA-C 116.542 1.377 . . . . 12.54 116.542 169.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -106.0 9.05 32.66 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.606 1.706 . . . . 13.2 115.606 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 65.77 -142.27 43.36 Favored Glycine 0 N--CA 1.465 0.621 0 N-CA-C 110.55 -1.02 . . . . 7.79 110.55 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.4 mtp -81.93 -0.96 46.26 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-O 121.243 0.544 . . . . 5.51 112.213 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.29 -22.0 66.8 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 123.736 0.814 . . . . 7.03 111.357 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.83 -32.98 15.42 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 123.715 0.634 . . . . 8.62 112.051 168.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.6 m-90 -92.06 103.57 16.06 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.142 -1.058 . . . . 9.63 108.142 174.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 113' ' ' ASN . 4.9 t -59.85 -31.15 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 N-CA-C 113.699 1.0 . . . . 10.27 113.699 179.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.24 84.62 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.796 0.665 . . . . 8.9 112.796 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.559 ' CD1' ' HB2' ' A' ' 115' ' ' CYS . 84.5 t90 -65.9 -44.25 85.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.306 0.574 . . . . 9.34 110.669 175.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.402 HH21 HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -68.16 -36.64 79.96 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.848 -0.614 . . . . 34.48 109.871 -175.133 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 109' ' ' VAL . 94.3 m-20 -89.71 -14.1 35.44 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 114.473 1.286 . . . . 11.12 114.473 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -131.44 -20.37 2.65 Favored 'General case' 0 CA--C 1.561 1.397 0 N-CA-C 116.967 2.21 . . . . 8.57 116.967 -174.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.559 ' HB2' ' CD1' ' A' ' 111' ' ' TRP . 61.4 m -116.45 -44.98 2.83 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.732 0.641 . . . . 9.3 112.732 -175.625 -56.266 -84.787 -95.97 103.37 2.07 107.227 -91.342 -171.016 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -50.29 121.32 5.43 Favored 'General case' 0 C--O 1.252 1.208 0 O-C-N 123.766 0.666 . . . . 12.62 110.974 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 86.15 -3.41 87.12 Favored Glycine 0 N--CA 1.465 0.621 0 CA-C-N 114.492 -1.231 . . . . 14.23 114.822 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 60.1 p -91.36 173.89 7.67 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 117.546 0.673 . . . . 13.55 111.015 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -85.55 82.85 8.1 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.652 1.215 . . . . 23.41 107.947 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.9 m -70.79 -32.39 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 114.184 -1.371 . . . . 15.79 113.592 -177.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -49.49 -20.86 0.8 Allowed 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.733 1.012 . . . . 31.08 113.733 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 1.101 ' O ' ' HG2' ' A' ' 125' ' ' ARG . . . -64.77 -26.81 68.52 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.943 -0.571 . . . . 17.15 110.763 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.494 ' CH2' ' HG2' ' A' ' 33' ' ' LYS . 96.5 m95 -68.77 -21.99 64.32 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 113.447 0.906 . . . . 16.56 113.447 179.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 20.9 pt -101.44 1.94 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 N-CA-C 115.035 1.494 . . . . 18.15 115.035 171.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . 1.101 ' HG2' ' O ' ' A' ' 122' ' ' ALA . 1.5 ptt85 -46.92 114.22 0.8 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.125 0.97 . . . . 37.07 113.362 173.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.07 18.9 60.12 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 117.662 1.825 . . . . 20.35 117.662 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 9.8 m -105.63 137.63 43.15 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 118.364 1.082 . . . . 21.1 112.834 -178.406 -44.782 -67.584 -69.86 103.489 2.029 101.991 -62.798 -70.333 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 -75.21 111.34 10.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.305 -0.998 . . . . 31.19 108.305 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.864 0.84 . . . . 25.43 111.734 -177.881 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . 0.747 ' O ' ' HB3' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_