data_3sel_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 3sel _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 ' X' X ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.058 -1.46 . . . . 21.859999999999999 107.058 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 2' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -95.24 151.98 18.76 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 108.058 -1.089 . . . . 20.300000000000001 108.058 -173.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 3' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -57.85 155.72 10.0 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 125.002 1.439 . . . . 19.309999999999999 112.102 164.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 4' ' ' ILE . . . . . . . . . . . . . 66.3 mt -114.8 153.54 16.28 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 115.591 -0.731 . . . . 19.280000000000001 109.859 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 15.4 t -123.04 128.11 74.97 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 105.579 -2.008 . . . . 18.670000000000002 105.579 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -90.28 127.53 36.17 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 106.364 -1.717 . . . . 16.149999999999999 106.364 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 7' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -88.01 59.82 5.51 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.542 -0.463 . . . . 27.449999999999999 112.152 -170.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.68 134.41 56.27 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.962 -0.295 . . . . 16.210000000000001 111.312 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -56.93 -38.14 72.48 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 112.558 0.577 . . . . 35.409999999999997 112.558 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 10' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -72.08 -12.24 61.12 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 115.449 1.648 . . . . 16.690000000000001 115.449 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.62 134.24 2.11 Favored Glycine 0 CA--C 1.529 0.931 0 O-C-N 123.759 0.662 . . . . 15.289999999999999 112.238 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -50.38 137.88 17.93 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 125.56 1.544 . . . . 20.48 110.47 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 113.81 44.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.373 -0.973 . . . . 13.81 108.373 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -75.57 138.79 41.71 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.229 -0.896 . . . . 34.82 110.4 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 15' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -117.19 98.19 51.65 Favored Pre-proline 0 N--CA 1.444 -0.746 0 CA-C-N 115.125 -0.943 . . . . 15.93 108.697 168.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 16' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -82.93 106.47 1.44 Allowed 'Trans proline' 0 C--O 1.258 1.517 0 C-N-CA 122.244 1.963 . . . . 14.109999999999999 112.235 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 17' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -66.81 -41.51 87.43 Favored 'General case' 0 CA--C 1.554 1.096 0 N-CA-C 114.779 1.4 . . . . 14.44 114.779 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 18' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -55.65 -46.08 77.55 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.101 0.778 . . . . 33.039999999999999 113.101 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.58 -38.73 69.76 Favored 'General case' 0 C--O 1.254 1.328 0 CA-C-O 121.209 0.528 . . . . 13.949999999999999 112.304 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 20' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -73.44 -43.85 59.45 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 113.151 0.797 . . . . 14.1 113.151 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 21' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -54.09 -45.1 71.7 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.056 0.455 . . . . 29.57 111.331 173.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -66.03 -48.19 71.91 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.226 1.195 . . . . 36.729999999999997 114.226 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.11 -19.09 30.7 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 115.137 1.532 . . . . 16.379999999999999 115.137 -173.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 24' ' ' VAL . . . . . . . . . . . . . 14.9 t -129.15 71.19 82.0 Favored Pre-proline 0 C--O 1.246 0.918 0 N-CA-C 107.893 -1.151 . . . . 16.190000000000001 107.893 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 25' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -22.38 74.47 Favored 'Trans proline' 0 C--N 1.329 -0.462 0 C-N-CA 121.456 1.437 . . . . 18.57 113.762 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -69.96 86.63 0.53 Allowed 'General case' 0 CA--C 1.564 1.482 0 CA-C-O 122.062 0.934 . . . . 21.890000000000001 112.51 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 27' ' ' CYS . . . . . . . . . . . . . 31.4 m -60.07 -29.84 68.82 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.858 1.058 . . . . 14.77 113.858 -172.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.96 -10.32 38.1 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 114.366 1.247 . . . . 24.809999999999999 114.366 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 29' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -60.19 -30.0 69.07 Favored 'General case' 0 C--O 1.196 -1.756 0 C-N-CA 120.131 -0.628 . . . . 34.289999999999999 109.832 169.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 30' ' ' CYS . . . . . 1.471 ' SG ' ' CAC' ' X' ' 72' ' ' HEM . 72.6 m -121.67 -31.28 4.02 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 116.886 2.18 . . . . 15.050000000000001 116.886 179.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 31' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -101.04 158.13 16.24 Favored 'General case' 0 C--O 1.203 -1.391 0 N-CA-C 113.268 0.84 . . . . 15.07 113.268 -173.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 32' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 58.4 35.93 25.09 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.939 1.352 . . . . 20.710000000000001 110.524 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 33' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -84.59 153.41 23.22 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 103.99 -2.596 . . . . 29.48 103.99 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.12 175.59 8.21 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-O 124.536 2.187 . . . . 26.07 111.096 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 35' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -59.71 147.11 93.49 Favored 'Trans proline' 0 C--N 1.315 -1.234 0 C-N-CA 123.524 2.816 . . . . 26.489999999999998 111.876 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 36' ' ' GLY . . . . . . . . . . . . . . . 103.88 -4.72 46.1 Favored Glycine 0 N--CA 1.44 -1.099 0 CA-C-O 118.268 -1.296 . . . . 21.16 112.774 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 37' ' ' LYS . . . . . 0.409 ' NZ ' ' O4 ' ' X' ' 75' ' ' DXC . 57.7 mmtt -76.18 -25.07 54.83 Favored 'General case' 0 C--O 1.194 -1.856 0 CA-C-N 118.523 1.162 . . . . 28.149999999999999 112.136 -173.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 38' ' ' ILE . . . . . . . . . . . . . 48.3 mt -71.48 -46.54 63.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 CA-C-N 118.357 0.526 . . . . 16.199999999999999 109.915 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -70.66 -23.3 62.48 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.102 0.408 . . . . 17.710000000000001 112.102 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.44 -18.42 64.3 Favored Glycine 0 C--O 1.251 1.175 0 N-CA-C 116.073 1.189 . . . . 18.780000000000001 116.073 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -76.16 143.35 41.21 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.548 0.69 . . . . 18.09 109.731 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.43 -164.73 29.82 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.238 -1.545 . . . . 16.510000000000002 109.238 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 43' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.83 -40.71 88.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 118.517 -0.754 . . . . 26.34 109.745 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.78 -48.4 81.97 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.737 0.648 . . . . 20.039999999999999 110.298 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 45' ' ' MET . . . . . . . . . . . . . 58.5 mmm -62.83 -46.28 88.66 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.4 -0.92 . . . . 36.75 110.402 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.86 -42.63 89.84 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.781 0.66 . . . . 15.75 112.781 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 47' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -84.41 -11.57 56.0 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.187 -0.915 . . . . 15.06 109.451 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 48' ' ' GLY . . . . . . . . . . . . . . . -104.1 -138.82 9.85 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 123.722 0.677 . . . . 18.059999999999999 111.451 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 49' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -67.32 -19.67 65.5 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.969 0.729 . . . . 37.920000000000002 112.969 -170.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.44 -33.02 79.46 Favored Glycine 0 C--O 1.209 -1.459 0 N-CA-C 117.287 1.675 . . . . 16.710000000000001 117.287 176.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 51' ' ' CYS . . . . . . . . . . . . . 31.5 m -141.79 -68.19 0.38 Allowed 'General case' 0 C--O 1.246 0.903 0 CA-C-N 118.224 1.012 . . . . 13.710000000000001 110.843 172.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -62.98 -46.85 85.75 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.801 -0.636 . . . . 25.390000000000001 111.168 -166.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 53' ' ' GLY . . . . . . . . . . . . . . . -57.68 -41.8 93.95 Favored Glycine 0 C--O 1.243 0.672 0 O-C-N 123.962 0.789 . . . . 17.359999999999999 111.802 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -63.33 -40.99 98.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.843 -1.543 . . . . 16.43 112.049 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.56 -40.01 77.98 Favored 'General case' 0 CA--C 1.556 1.196 0 O-C-N 122.222 -0.298 . . . . 18.41 111.74 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -68.1 -45.03 74.87 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.394 0.887 . . . . 36.280000000000001 113.394 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 57' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.41 -40.11 92.97 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.068 0.766 . . . . 45.729999999999997 113.068 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 58' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -76.51 -15.78 59.8 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.425 -0.352 . . . . 29.41 110.969 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 59' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt 65.72 25.84 11.43 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.464 0.913 . . . . 35.939999999999998 113.464 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 60' ' ' LYS . . . . . . . . . . . . . 2.6 tptm -158.79 142.24 14.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.255 -0.429 . . . . 32.509999999999998 110.044 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.64 159.49 13.37 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.54 -1.024 . . . . 17.25 110.54 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 62' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -65.19 129.06 21.88 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 120.911 1.074 . . . . 15.619999999999999 114.086 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 63' ' ' THR . . . . . . . . . . . . . 72.0 p -125.72 -0.7 7.38 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.153 1.538 . . . . 15.48 115.153 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmtm -101.69 152.35 20.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.56 -0.533 . . . . 26.170000000000002 109.56 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 65' ' ' CYS . . . . . . . . . . . . . 6.3 m -45.54 -53.38 9.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.115 0.783 . . . . 13.029999999999999 113.115 -176.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 66' ' ' GLY . . . . . . . . . . . . . . . -79.87 -11.77 84.21 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.674 -0.694 . . . . 14.82 111.727 -170.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 67' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -77.19 -26.98 53.45 Favored 'General case' 0 C--O 1.209 -1.044 0 N-CA-C 113.021 0.749 . . . . 22.18 113.021 171.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 68' ' ' CYS . . . . . 1.363 ' SG ' ' CAC' ' X' ' 74' ' ' HEM . 59.4 m -96.06 -46.08 6.63 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 121.199 -0.938 . . . . 13.720000000000001 113.264 172.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 69' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -92.26 124.27 36.21 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 124.344 1.028 . . . . 16.260000000000002 110.935 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 70' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -146.24 120.8 9.75 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.61 0.569 . . . . 40.329999999999998 110.837 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 71' ' ' LYS . . . . . . . . . . . . . 78.2 mttt . . . . . 0 C--O 1.244 0.769 0 N-CA-C 113.355 0.872 . . . . 34.590000000000003 113.355 175.805 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 72' ' ' HEM . . . . . 1.471 ' CAC' ' SG ' ' X' ' 30' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 73' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 74' ' ' HEM . . . . . 1.363 ' CAC' ' SG ' ' X' ' 68' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 75' ' ' DXC . . . . . 0.409 ' O4 ' ' NZ ' ' X' ' 37' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.058 -1.46 . . . . 21.859999999999999 107.058 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 2' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -95.24 151.98 18.76 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 108.058 -1.089 . . . . 20.300000000000001 108.058 -173.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 3' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -57.85 155.72 10.0 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 125.002 1.439 . . . . 19.309999999999999 112.102 164.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 4' ' ' ILE . . . . . 0.455 HD11 ' H71' ' X' ' 75' ' ' DXC . 66.3 mt -114.8 153.54 16.28 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 115.591 -0.731 . . . . 20.280000000000001 109.859 -179.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 15.4 t -123.04 128.11 74.97 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 105.579 -2.008 . . . . 18.670000000000002 105.579 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -90.28 127.53 36.17 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 106.364 -1.717 . . . . 16.149999999999999 106.364 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 7' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -88.01 59.82 5.51 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.542 -0.463 . . . . 27.449999999999999 112.152 -170.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.68 134.41 56.27 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.962 -0.295 . . . . 16.210000000000001 111.312 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -56.93 -38.14 72.48 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 112.558 0.577 . . . . 35.409999999999997 112.558 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 10' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -72.08 -12.24 61.12 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 115.449 1.648 . . . . 16.690000000000001 115.449 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.62 134.24 2.11 Favored Glycine 0 CA--C 1.529 0.931 0 O-C-N 123.759 0.662 . . . . 15.289999999999999 112.238 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -50.38 137.88 17.93 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 125.56 1.544 . . . . 20.48 110.47 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 113.81 44.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.373 -0.973 . . . . 13.81 108.373 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -75.57 138.79 41.71 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.229 -0.896 . . . . 34.82 110.4 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 15' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -117.19 98.19 51.65 Favored Pre-proline 0 N--CA 1.444 -0.746 0 CA-C-N 115.125 -0.943 . . . . 15.93 108.697 168.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 16' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -82.93 106.47 1.44 Allowed 'Trans proline' 0 C--O 1.258 1.517 0 C-N-CA 122.244 1.963 . . . . 14.109999999999999 112.235 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 17' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -66.81 -41.51 87.43 Favored 'General case' 0 CA--C 1.554 1.096 0 N-CA-C 114.779 1.4 . . . . 14.44 114.779 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 18' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -55.65 -46.08 77.55 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.101 0.778 . . . . 33.039999999999999 113.101 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.58 -38.73 69.76 Favored 'General case' 0 C--O 1.254 1.328 0 CA-C-O 121.209 0.528 . . . . 13.949999999999999 112.304 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 20' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -73.44 -43.85 59.45 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 113.151 0.797 . . . . 14.1 113.151 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 21' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -54.09 -45.1 71.7 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.056 0.455 . . . . 29.57 111.331 173.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -66.03 -48.19 71.91 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.226 1.195 . . . . 36.729999999999997 114.226 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.11 -19.09 30.7 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 115.137 1.532 . . . . 16.379999999999999 115.137 -173.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 24' ' ' VAL . . . . . . . . . . . . . 14.9 t -129.15 71.19 82.0 Favored Pre-proline 0 C--O 1.246 0.918 0 N-CA-C 107.893 -1.151 . . . . 16.190000000000001 107.893 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 25' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -22.38 74.47 Favored 'Trans proline' 0 C--N 1.329 -0.462 0 C-N-CA 121.456 1.437 . . . . 18.57 113.762 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -69.96 86.63 0.53 Allowed 'General case' 0 CA--C 1.564 1.482 0 CA-C-O 122.062 0.934 . . . . 21.890000000000001 112.51 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 27' ' ' CYS . . . . . . . . . . . . . 31.4 m -60.07 -29.84 68.82 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.858 1.058 . . . . 14.77 113.858 -172.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.96 -10.32 38.1 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 114.366 1.247 . . . . 24.809999999999999 114.366 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 29' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -60.19 -30.0 69.07 Favored 'General case' 0 C--O 1.196 -1.756 0 C-N-CA 120.131 -0.628 . . . . 34.289999999999999 109.832 169.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 30' ' ' CYS . . . . . 1.471 ' SG ' ' CAC' ' X' ' 72' ' ' HEM . 72.6 m -121.67 -31.28 4.02 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 116.886 2.18 . . . . 15.050000000000001 116.886 179.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 31' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -101.04 158.13 16.24 Favored 'General case' 0 C--O 1.203 -1.391 0 N-CA-C 113.268 0.84 . . . . 15.07 113.268 -173.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 32' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 58.4 35.93 25.09 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.939 1.352 . . . . 20.710000000000001 110.524 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 33' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -84.59 153.41 23.22 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 103.99 -2.596 . . . . 29.48 103.99 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.12 175.59 8.21 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-O 124.536 2.187 . . . . 26.07 111.096 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 35' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -59.71 147.11 93.49 Favored 'Trans proline' 0 C--N 1.315 -1.234 0 C-N-CA 123.524 2.816 . . . . 26.489999999999998 111.876 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 36' ' ' GLY . . . . . . . . . . . . . . . 103.88 -4.72 46.1 Favored Glycine 0 N--CA 1.44 -1.099 0 CA-C-O 118.268 -1.296 . . . . 21.16 112.774 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 37' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 133' ' ' HOH . 57.7 mmtt -76.18 -25.07 54.83 Favored 'General case' 0 C--O 1.194 -1.856 0 CA-C-N 118.523 1.162 . . . . 28.149999999999999 112.136 -173.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 38' ' ' ILE . . . . . . . . . . . . . 48.3 mt -71.48 -46.54 63.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 CA-C-N 118.357 0.526 . . . . 16.199999999999999 109.915 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -70.66 -23.3 62.48 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.102 0.408 . . . . 17.710000000000001 112.102 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.44 -18.42 64.3 Favored Glycine 0 C--O 1.251 1.175 0 N-CA-C 116.073 1.189 . . . . 18.780000000000001 116.073 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -76.16 143.35 41.21 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.548 0.69 . . . . 18.09 109.731 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.43 -164.73 29.82 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.238 -1.545 . . . . 16.510000000000002 109.238 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 43' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.83 -40.71 88.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 118.517 -0.754 . . . . 26.34 109.745 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.78 -48.4 81.97 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.737 0.648 . . . . 20.039999999999999 110.298 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 45' ' ' MET . . . . . . . . . . . . . 58.5 mmm -62.83 -46.28 88.66 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.4 -0.92 . . . . 36.75 110.402 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.86 -42.63 89.84 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.781 0.66 . . . . 15.75 112.781 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 47' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -84.41 -11.57 56.0 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.187 -0.915 . . . . 15.06 109.451 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 48' ' ' GLY . . . . . . . . . . . . . . . -104.1 -138.82 9.85 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 123.722 0.677 . . . . 18.059999999999999 111.451 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 49' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -67.32 -19.67 65.5 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.969 0.729 . . . . 37.920000000000002 112.969 -170.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.44 -33.02 79.46 Favored Glycine 0 C--O 1.209 -1.459 0 N-CA-C 117.287 1.675 . . . . 16.710000000000001 117.287 176.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 51' ' ' CYS . . . . . . . . . . . . . 31.5 m -141.79 -68.19 0.38 Allowed 'General case' 0 C--O 1.246 0.903 0 CA-C-N 118.224 1.012 . . . . 13.710000000000001 110.843 172.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -62.98 -46.85 85.75 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.801 -0.636 . . . . 25.390000000000001 111.168 -166.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 53' ' ' GLY . . . . . . . . . . . . . . . -57.68 -41.8 93.95 Favored Glycine 0 C--O 1.243 0.672 0 O-C-N 123.962 0.789 . . . . 17.359999999999999 111.802 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -63.33 -40.99 98.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.843 -1.543 . . . . 16.43 112.049 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.56 -40.01 77.98 Favored 'General case' 0 CA--C 1.556 1.196 0 O-C-N 122.222 -0.298 . . . . 18.41 111.74 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -68.1 -45.03 74.87 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.394 0.887 . . . . 36.280000000000001 113.394 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 57' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.41 -40.11 92.97 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.068 0.766 . . . . 45.729999999999997 113.068 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 58' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -76.51 -15.78 59.8 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.425 -0.352 . . . . 29.41 110.969 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 59' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt 65.72 25.84 11.43 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.464 0.913 . . . . 35.939999999999998 113.464 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 60' ' ' LYS . . . . . . . . . . . . . 2.6 tptm -158.79 142.24 14.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.255 -0.429 . . . . 32.509999999999998 110.044 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.64 159.49 13.37 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.54 -1.024 . . . . 17.25 110.54 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 62' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -65.19 129.06 21.88 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 120.911 1.074 . . . . 15.619999999999999 114.086 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 63' ' ' THR . . . . . . . . . . . . . 72.0 p -125.72 -0.7 7.38 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.153 1.538 . . . . 15.48 115.153 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmtm -101.69 152.35 20.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.56 -0.533 . . . . 26.170000000000002 109.56 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 65' ' ' CYS . . . . . . . . . . . . . 6.3 m -45.54 -53.38 9.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.115 0.783 . . . . 13.029999999999999 113.115 -176.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 66' ' ' GLY . . . . . . . . . . . . . . . -79.87 -11.77 84.21 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.674 -0.694 . . . . 14.82 111.727 -170.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 67' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -77.19 -26.98 53.45 Favored 'General case' 0 C--O 1.209 -1.044 0 N-CA-C 113.021 0.749 . . . . 22.18 113.021 171.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 68' ' ' CYS . . . . . 1.363 ' SG ' ' CAC' ' X' ' 74' ' ' HEM . 59.4 m -96.06 -46.08 6.63 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 121.199 -0.938 . . . . 13.720000000000001 113.264 172.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 69' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -92.26 124.27 36.21 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 124.344 1.028 . . . . 16.260000000000002 110.935 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 70' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -146.24 120.8 9.75 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.61 0.569 . . . . 40.329999999999998 110.837 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 71' ' ' LYS . . . . . . . . . . . . . 78.2 mttt . . . . . 0 C--O 1.244 0.769 0 N-CA-C 113.355 0.872 . . . . 34.590000000000003 113.355 175.805 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 72' ' ' HEM . . . . . 1.471 ' CAC' ' SG ' ' X' ' 30' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 73' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 74' ' ' HEM . . . . . 1.363 ' CAC' ' SG ' ' X' ' 68' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 75' ' ' DXC . . . . . 0.455 ' H71' HD11 ' X' ' 4' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 133' ' ' HOH . . . . . 0.634 ' O ' ' HB2' ' X' ' 37' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.058 -1.46 . . . . 21.859999999999999 107.058 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 2' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -95.24 151.98 18.76 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 108.058 -1.089 . . . . 20.300000000000001 108.058 -173.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 3' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -57.85 155.72 10.0 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 125.002 1.439 . . . . 19.309999999999999 112.102 164.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 4' ' ' ILE . . . . . 0.455 HD11 ' H71' ' X' ' 75' ' ' DXC . 66.3 mt -114.8 153.54 16.28 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 115.591 -0.731 . . . . 20.280000000000001 109.859 -179.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 15.4 t -123.04 128.11 74.97 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 105.579 -2.008 . . . . 18.670000000000002 105.579 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mp -90.28 127.53 36.17 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 106.364 -1.717 . . . . 16.149999999999999 106.364 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 7' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -88.01 59.82 5.51 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.542 -0.463 . . . . 27.449999999999999 112.152 -170.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.68 134.41 56.27 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.962 -0.295 . . . . 16.210000000000001 111.312 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -56.93 -38.14 72.48 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 112.558 0.577 . . . . 35.409999999999997 112.558 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 10' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -72.08 -12.24 61.12 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 115.449 1.648 . . . . 16.690000000000001 115.449 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.62 134.24 2.11 Favored Glycine 0 CA--C 1.529 0.931 0 O-C-N 123.759 0.662 . . . . 15.289999999999999 112.238 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -50.38 137.88 17.93 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 125.56 1.544 . . . . 20.48 110.47 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 113.81 44.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.373 -0.973 . . . . 13.81 108.373 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -75.57 138.79 41.71 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.229 -0.896 . . . . 34.82 110.4 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 15' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -117.19 98.19 51.65 Favored Pre-proline 0 N--CA 1.444 -0.746 0 CA-C-N 115.125 -0.943 . . . . 15.93 108.697 168.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 16' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -82.93 106.47 1.44 Allowed 'Trans proline' 0 C--O 1.258 1.517 0 C-N-CA 122.244 1.963 . . . . 14.109999999999999 112.235 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 17' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -66.81 -41.51 87.43 Favored 'General case' 0 CA--C 1.554 1.096 0 N-CA-C 114.779 1.4 . . . . 14.44 114.779 -174.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 18' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -55.65 -46.08 77.55 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.101 0.778 . . . . 33.039999999999999 113.101 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.58 -38.73 69.76 Favored 'General case' 0 C--O 1.254 1.328 0 CA-C-O 121.209 0.528 . . . . 13.949999999999999 112.304 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 20' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -73.44 -43.85 59.45 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 113.151 0.797 . . . . 14.1 113.151 -179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 21' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -54.09 -45.1 71.7 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.056 0.455 . . . . 29.57 111.331 173.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt -66.03 -48.19 71.91 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 114.226 1.195 . . . . 36.729999999999997 114.226 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.11 -19.09 30.7 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 115.137 1.532 . . . . 16.379999999999999 115.137 -173.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 24' ' ' VAL . . . . . . . . . . . . . 14.9 t -129.15 71.19 82.0 Favored Pre-proline 0 C--O 1.246 0.918 0 N-CA-C 107.893 -1.151 . . . . 16.190000000000001 107.893 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 25' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -22.38 74.47 Favored 'Trans proline' 0 C--N 1.329 -0.462 0 C-N-CA 121.456 1.437 . . . . 18.57 113.762 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -69.96 86.63 0.53 Allowed 'General case' 0 CA--C 1.564 1.482 0 CA-C-O 122.062 0.934 . . . . 21.890000000000001 112.51 166.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 27' ' ' CYS . . . . . . . . . . . . . 31.4 m -60.07 -29.84 68.82 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.858 1.058 . . . . 14.77 113.858 -172.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.96 -10.32 38.1 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 114.366 1.247 . . . . 24.809999999999999 114.366 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 29' ' ' LYS . . . . . . . . . . . . . 8.8 mmtp -60.19 -30.0 69.07 Favored 'General case' 0 C--O 1.196 -1.756 0 C-N-CA 120.131 -0.628 . . . . 34.289999999999999 109.832 169.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 30' ' ' CYS . . . . . 1.471 ' SG ' ' CAC' ' X' ' 72' ' ' HEM . 72.6 m -121.67 -31.28 4.02 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 116.886 2.18 . . . . 15.050000000000001 116.886 179.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 31' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -101.04 158.13 16.24 Favored 'General case' 0 C--O 1.203 -1.391 0 N-CA-C 113.268 0.84 . . . . 15.07 113.268 -173.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 32' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 58.4 35.93 25.09 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 122.939 1.352 . . . . 20.710000000000001 110.524 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 33' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -84.59 153.41 23.22 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 103.99 -2.596 . . . . 29.48 103.99 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.12 175.59 8.21 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-O 124.536 2.187 . . . . 26.07 111.096 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 35' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -59.71 147.11 93.49 Favored 'Trans proline' 0 C--N 1.315 -1.234 0 C-N-CA 123.524 2.816 . . . . 26.489999999999998 111.876 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 36' ' ' GLY . . . . . . . . . . . . . . . 103.88 -4.72 46.1 Favored Glycine 0 N--CA 1.44 -1.099 0 CA-C-O 118.268 -1.296 . . . . 21.16 112.774 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 133' ' ' HOH . 57.7 mmtt -76.18 -25.07 54.83 Favored 'General case' 0 C--O 1.194 -1.856 0 CA-C-N 118.523 1.162 . . . . 28.149999999999999 112.136 -173.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 38' ' ' ILE . . . . . . . . . . . . . 48.3 mt -71.48 -46.54 63.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 CA-C-N 118.357 0.526 . . . . 16.199999999999999 109.915 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -70.66 -23.3 62.48 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.102 0.408 . . . . 17.710000000000001 112.102 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.44 -18.42 64.3 Favored Glycine 0 C--O 1.251 1.175 0 N-CA-C 116.073 1.189 . . . . 18.780000000000001 116.073 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -76.16 143.35 41.21 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.548 0.69 . . . . 18.09 109.731 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.43 -164.73 29.82 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.238 -1.545 . . . . 16.510000000000002 109.238 -177.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 43' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.83 -40.71 88.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 118.517 -0.754 . . . . 26.34 109.745 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.78 -48.4 81.97 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.737 0.648 . . . . 20.039999999999999 110.298 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 45' ' ' MET . . . . . . . . . . . . . 58.5 mmm -62.83 -46.28 88.66 Favored 'General case' 0 C--O 1.209 -1.042 0 C-N-CA 119.4 -0.92 . . . . 36.75 110.402 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.86 -42.63 89.84 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.781 0.66 . . . . 15.75 112.781 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 47' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -84.41 -11.57 56.0 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.187 -0.915 . . . . 15.06 109.451 -177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 48' ' ' GLY . . . . . . . . . . . . . . . -104.1 -138.82 9.85 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 123.722 0.677 . . . . 18.059999999999999 111.451 172.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 49' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -67.32 -19.67 65.5 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.969 0.729 . . . . 37.920000000000002 112.969 -170.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.44 -33.02 79.46 Favored Glycine 0 C--O 1.209 -1.459 0 N-CA-C 117.287 1.675 . . . . 16.710000000000001 117.287 176.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 51' ' ' CYS . . . . . . . . . . . . . 31.5 m -141.79 -68.19 0.38 Allowed 'General case' 0 C--O 1.246 0.903 0 CA-C-N 118.224 1.012 . . . . 13.710000000000001 110.843 172.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -62.98 -46.85 85.75 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.801 -0.636 . . . . 25.390000000000001 111.168 -166.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 53' ' ' GLY . . . . . . . . . . . . . . . -57.68 -41.8 93.95 Favored Glycine 0 C--O 1.243 0.672 0 O-C-N 123.962 0.789 . . . . 17.359999999999999 111.802 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -63.33 -40.99 98.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.843 -1.543 . . . . 16.43 112.049 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 55' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -57.56 -40.01 77.98 Favored 'General case' 0 CA--C 1.556 1.196 0 O-C-N 122.222 -0.298 . . . . 18.41 111.74 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -68.1 -45.03 74.87 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.394 0.887 . . . . 36.280000000000001 113.394 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 57' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.41 -40.11 92.97 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.068 0.766 . . . . 45.729999999999997 113.068 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 58' ' ' ASN . . . . . 0.482 HD22 ' N ' ' X' ' 58' ' ' ASN . 8.4 t30 -76.51 -15.78 59.8 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.425 -0.352 . . . . 29.41 110.969 -177.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 59' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt 65.72 25.84 11.43 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.464 0.913 . . . . 35.939999999999998 113.464 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 60' ' ' LYS . . . . . . . . . . . . . 2.6 tptm -158.79 142.24 14.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.255 -0.429 . . . . 32.509999999999998 110.044 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.64 159.49 13.37 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.54 -1.024 . . . . 17.25 110.54 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 62' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -65.19 129.06 21.88 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 120.911 1.074 . . . . 15.619999999999999 114.086 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 63' ' ' THR . . . . . . . . . . . . . 72.0 p -125.72 -0.7 7.38 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.153 1.538 . . . . 15.48 115.153 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmtm -101.69 152.35 20.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.56 -0.533 . . . . 26.170000000000002 109.56 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 65' ' ' CYS . . . . . . . . . . . . . 6.3 m -45.54 -53.38 9.08 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.115 0.783 . . . . 13.029999999999999 113.115 -176.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 66' ' ' GLY . . . . . . . . . . . . . . . -79.87 -11.77 84.21 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 115.674 -0.694 . . . . 14.82 111.727 -170.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 67' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -77.19 -26.98 53.45 Favored 'General case' 0 C--O 1.209 -1.044 0 N-CA-C 113.021 0.749 . . . . 22.18 113.021 171.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 68' ' ' CYS . . . . . 1.363 ' SG ' ' CAC' ' X' ' 74' ' ' HEM . 59.4 m -96.06 -46.08 6.63 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 121.199 -0.938 . . . . 13.720000000000001 113.264 172.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 69' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -92.26 124.27 36.21 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 124.344 1.028 . . . . 16.260000000000002 110.935 -174.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 70' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -146.24 120.8 9.75 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.61 0.569 . . . . 40.329999999999998 110.837 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 71' ' ' LYS . . . . . . . . . . . . . 78.2 mttt . . . . . 0 C--O 1.244 0.769 0 N-CA-C 113.355 0.872 . . . . 34.590000000000003 113.355 175.805 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 72' ' ' HEM . . . . . 1.471 ' CAC' ' SG ' ' X' ' 30' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 73' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 74' ' ' HEM . . . . . 1.363 ' CAC' ' SG ' ' X' ' 68' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 75' ' ' DXC . . . . . 0.455 ' H71' HD11 ' X' ' 4' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 133' ' ' HOH . . . . . 0.634 ' O ' ' HB2' ' X' ' 37' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_