data_5ehb_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 5ehb _Structure_validation_residue.Date_analyzed 2016-10-13 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' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.266 1.937 0 CA-C-O 123.03 1.395 . . . . 121.25 111.996 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -43.7 78.48 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 113.553 -1.658 . . . . 121.25 112.254 -171.13 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -51.58 -43.8 62.56 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.833 1.049 . . . . 121.25 113.833 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 35.6 mt -64.37 -38.97 83.93 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 N-CA-C 111.839 0.311 . . . . 121.25 111.839 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' IYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -52.66 -43.4 65.49 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.898 0.879 . . . . 121.25 111.9 174.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.41 23.19 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 116.405 -0.361 . . . . 121.25 111.161 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.53 -34.69 74.48 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 113.34 0.867 . . . . 121.25 113.34 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -68.19 -55.28 12.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-O 121.079 0.466 . . . . 121.25 110.331 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -52.41 -46.53 66.37 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 114.875 -1.057 . . . . 121.25 109.122 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.57 -57.22 11.5 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 124.028 0.83 . . . . 121.25 111.264 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.03 61.96 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 112.919 0.711 . . . . 121.25 112.919 -176.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.82 -44.99 19.78 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 114.551 -1.204 . . . . 121.25 112.397 174.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 96.1 mt -58.38 -40.34 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 118.019 0.372 . . . . 121.25 111.443 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -67.27 -39.56 86.07 Favored 'General case' 0 C--O 1.255 1.347 0 C-N-CA 120.108 -0.637 . . . . 121.25 111.119 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -56.05 -47.41 77.97 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 114.644 -1.162 . . . . 121.25 111.134 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -65.24 -40.19 93.7 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.718 -0.475 . . . . 121.25 109.718 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.04 -52.64 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.142 0.428 . . . . 121.25 110.261 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.9 84.91 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 119.663 -0.815 . . . . 121.25 111.304 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -40.48 -60.49 1.1 Allowed 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.27 -0.877 . . . . 121.25 110.202 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -56.66 -46.01 81.31 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.787 -1.097 . . . . 121.25 111.034 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.1 mt -58.87 -50.77 72.77 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.879 0.737 . . . . 121.25 112.613 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 -63.36 -48.72 76.76 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 119.139 -1.024 . . . . 121.25 109.254 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.91 -41.22 11.18 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.381 0.882 . . . . 121.25 113.381 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.57 -41.71 92.6 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.817 0.673 . . . . 121.25 112.817 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.5 mt -66.68 -21.07 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 114.347 1.24 . . . . 121.25 114.347 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -63.4 -16.45 60.54 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.118 1.155 . . . . 121.25 114.118 170.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.103 0 CA-C-O 121.009 0.433 . . . . 121.25 110.204 164.05 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 114.607 1.336 . . . . 121.25 114.607 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -49.99 -43.42 50.48 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.273 -0.892 . . . . 121.25 109.772 166.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -50.8 -42.91 58.54 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 112.59 0.589 . . . . 121.25 112.59 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.2 mt -63.24 -38.67 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 123.58 0.55 . . . . 121.25 111.93 172.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' IYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -54.23 -43.1 70.56 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.423 0.689 . . . . 121.25 112.703 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.5 -55.29 19.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.073 -0.512 . . . . 121.25 110.064 168.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.64 -36.07 71.35 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.378 0.881 . . . . 121.25 113.378 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.25 -54.84 14.86 Favored 'General case' 0 C--O 1.283 2.819 0 CA-C-O 121.515 0.674 . . . . 121.25 112.035 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -52.54 -45.25 66.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 114.389 -1.278 . . . . 121.25 111.109 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -54.11 -57.63 10.4 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.453 -0.794 . . . . 121.25 110.441 171.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.68 -49.54 47.17 Favored 'General case' 0 C--O 1.258 1.518 0 CA-C-O 121.198 0.523 . . . . 121.25 112.202 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -46.59 -44.15 17.9 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 113.905 1.076 . . . . 121.25 113.905 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.81 -39.81 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.07 -0.394 . . . . 121.25 111.558 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -65.79 -39.95 91.45 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.685 -0.487 . . . . 121.25 109.685 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -55.23 -48.44 73.91 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.802 0.689 . . . . 121.25 110.157 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -65.19 -38.76 91.5 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 120.371 -0.532 . . . . 121.25 111.52 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 88.4 mt -56.87 -51.17 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 122.353 -0.217 . . . . 121.25 111.463 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.68 83.22 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 119.286 -0.388 . . . . 121.25 110.147 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -41.12 -60.8 1.13 Allowed 'General case' 0 C--O 1.267 1.975 0 O-C-N 124.776 1.298 . . . . 121.25 108.253 170.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -56.47 -45.15 81.05 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.865 -1.061 . . . . 121.25 113.128 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.14 -51.22 70.97 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 113.055 0.761 . . . . 121.25 113.055 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 5.4 ptt-85 -62.93 -49.05 76.31 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 107.547 -1.279 . . . . 121.25 107.547 178.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -46.11 -40.97 11.74 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.414 0.894 . . . . 121.25 113.414 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.24 -41.57 89.82 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.003 0.742 . . . . 121.25 113.003 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.71 -20.39 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 113.756 1.021 . . . . 121.25 113.756 -164.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -62.41 -17.95 60.46 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.66 0.985 . . . . 121.25 113.66 170.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 122.44 0.296 . . . . 121.25 110.594 164.699 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . 0.409 HG22 HD12 ' A' ' 4' ' ' ILE . 5.1 t . . . . . 0 C--O 1.266 1.937 0 CA-C-O 123.03 1.395 . . . . 121.25 111.996 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -43.7 78.48 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 113.553 -1.658 . . . . 121.25 112.254 -171.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -51.58 -43.8 62.56 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.833 1.049 . . . . 121.25 113.833 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . 0.409 HD12 HG22 ' A' ' 1' ' ' THR . 35.6 mt -64.37 -38.97 83.93 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 N-CA-C 111.839 0.311 . . . . 121.25 111.839 172.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' IYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -52.66 -43.4 65.49 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.898 0.879 . . . . 121.25 111.9 174.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.41 23.19 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 116.405 -0.361 . . . . 121.25 111.161 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.53 -34.69 74.48 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 113.34 0.867 . . . . 121.25 113.34 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -68.19 -55.28 12.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-O 121.079 0.466 . . . . 121.25 110.331 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -52.41 -46.53 66.37 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 114.875 -1.057 . . . . 121.25 109.122 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.57 -57.22 11.5 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 124.028 0.83 . . . . 121.25 111.264 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.03 61.96 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 112.919 0.711 . . . . 121.25 112.919 -176.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.82 -44.99 19.78 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 114.551 -1.204 . . . . 121.25 112.397 174.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 96.1 mt -58.38 -40.34 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 118.019 0.372 . . . . 121.25 111.443 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -67.27 -39.56 86.07 Favored 'General case' 0 C--O 1.255 1.347 0 C-N-CA 120.108 -0.637 . . . . 121.25 111.119 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -56.05 -47.41 77.97 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 114.644 -1.162 . . . . 121.25 111.134 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -65.24 -40.19 93.7 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.718 -0.475 . . . . 121.25 109.718 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.04 -52.64 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.142 0.428 . . . . 121.25 110.261 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.9 84.91 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 119.663 -0.815 . . . . 121.25 111.304 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -40.48 -60.49 1.1 Allowed 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.27 -0.877 . . . . 121.25 110.202 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -56.66 -46.01 81.31 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.787 -1.097 . . . . 121.25 111.034 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.1 mt -58.87 -50.77 72.77 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.879 0.737 . . . . 121.25 112.613 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 -63.36 -48.72 76.76 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 119.139 -1.024 . . . . 121.25 109.254 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.91 -41.22 11.18 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.381 0.882 . . . . 121.25 113.381 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.57 -41.71 92.6 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.817 0.673 . . . . 121.25 112.817 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.5 mt -66.68 -21.07 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 114.347 1.24 . . . . 121.25 114.347 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -63.4 -16.45 60.54 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.118 1.155 . . . . 121.25 114.118 170.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.103 0 CA-C-O 121.009 0.433 . . . . 121.25 110.204 164.05 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' THR . . . . . 0.443 HG23 ' HG ' ' B' ' 5' ' ' IYR . 5.5 t . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 114.607 1.336 . . . . 121.25 114.607 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -49.99 -43.42 50.48 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.273 -0.892 . . . . 121.25 109.772 166.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -50.8 -42.91 58.54 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 112.59 0.589 . . . . 121.25 112.59 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.2 mt -63.24 -38.67 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 123.58 0.55 . . . . 121.25 111.93 172.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' IYR . . . . . 0.443 ' HG ' HG23 ' B' ' 1' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -54.23 -43.1 70.56 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.423 0.689 . . . . 121.25 112.703 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.5 -55.29 19.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.073 -0.512 . . . . 121.25 110.064 168.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.64 -36.07 71.35 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.378 0.881 . . . . 121.25 113.378 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.25 -54.84 14.86 Favored 'General case' 0 C--O 1.283 2.819 0 CA-C-O 121.515 0.674 . . . . 121.25 112.035 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -52.54 -45.25 66.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 114.389 -1.278 . . . . 121.25 111.109 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -54.11 -57.63 10.4 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.453 -0.794 . . . . 121.25 110.441 171.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.68 -49.54 47.17 Favored 'General case' 0 C--O 1.258 1.518 0 CA-C-O 121.198 0.523 . . . . 121.25 112.202 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -46.59 -44.15 17.9 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 113.905 1.076 . . . . 121.25 113.905 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.81 -39.81 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.07 -0.394 . . . . 121.25 111.558 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -65.79 -39.95 91.45 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.685 -0.487 . . . . 121.25 109.685 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -55.23 -48.44 73.91 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.802 0.689 . . . . 121.25 110.157 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -65.19 -38.76 91.5 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 120.371 -0.532 . . . . 121.25 111.52 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 88.4 mt -56.87 -51.17 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 122.353 -0.217 . . . . 121.25 111.463 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.68 83.22 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 119.286 -0.388 . . . . 121.25 110.147 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -41.12 -60.8 1.13 Allowed 'General case' 0 C--O 1.267 1.975 0 O-C-N 124.776 1.298 . . . . 121.25 108.253 170.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -56.47 -45.15 81.05 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.865 -1.061 . . . . 121.25 113.128 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.14 -51.22 70.97 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 113.055 0.761 . . . . 121.25 113.055 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 5.4 ptt-85 -62.93 -49.05 76.31 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 107.547 -1.279 . . . . 121.25 107.547 178.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -46.11 -40.97 11.74 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.414 0.894 . . . . 121.25 113.414 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.24 -41.57 89.82 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.003 0.742 . . . . 121.25 113.003 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.71 -20.39 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 113.756 1.021 . . . . 121.25 113.756 -164.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -62.41 -17.95 60.46 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.66 0.985 . . . . 121.25 113.66 170.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 122.44 0.296 . . . . 121.25 110.594 164.699 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . 0.409 HG22 HD12 ' A' ' 4' ' ' ILE . 5.1 t . . . . . 0 C--O 1.266 1.937 0 CA-C-O 123.03 1.395 . . . . 121.25 111.996 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -43.7 78.48 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 113.553 -1.658 . . . . 121.25 112.254 -171.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -51.58 -43.8 62.56 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.833 1.049 . . . . 121.25 113.833 170.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.409 HD12 HG22 ' A' ' 1' ' ' THR . 35.6 mt -64.37 -38.97 83.93 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 N-CA-C 111.839 0.311 . . . . 121.25 111.839 172.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' IYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -52.66 -43.4 65.49 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.898 0.879 . . . . 121.25 111.9 174.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.41 23.19 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 116.405 -0.361 . . . . 121.25 111.161 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.53 -34.69 74.48 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 113.34 0.867 . . . . 121.25 113.34 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -68.19 -55.28 12.88 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-O 121.079 0.466 . . . . 121.25 110.331 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -52.41 -46.53 66.37 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 114.875 -1.057 . . . . 121.25 109.122 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.57 -57.22 11.5 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 124.028 0.83 . . . . 121.25 111.264 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.03 61.96 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 112.919 0.711 . . . . 121.25 112.919 -176.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.82 -44.99 19.78 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 114.551 -1.204 . . . . 121.25 112.397 174.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 96.1 mt -58.38 -40.34 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 118.019 0.372 . . . . 121.25 111.443 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -67.27 -39.56 86.07 Favored 'General case' 0 C--O 1.255 1.347 0 C-N-CA 120.108 -0.637 . . . . 121.25 111.119 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -56.05 -47.41 77.97 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 114.644 -1.162 . . . . 121.25 111.134 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -65.24 -40.19 93.7 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.718 -0.475 . . . . 121.25 109.718 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.04 -52.64 47.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.142 0.428 . . . . 121.25 110.261 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.9 84.91 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 119.663 -0.815 . . . . 121.25 111.304 178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -40.48 -60.49 1.1 Allowed 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 115.27 -0.877 . . . . 121.25 110.202 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -56.66 -46.01 81.31 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.787 -1.097 . . . . 121.25 111.034 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.1 mt -58.87 -50.77 72.77 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.879 0.737 . . . . 121.25 112.613 -177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 -63.36 -48.72 76.76 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 119.139 -1.024 . . . . 121.25 109.254 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.91 -41.22 11.18 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.381 0.882 . . . . 121.25 113.381 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.57 -41.71 92.6 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.817 0.673 . . . . 121.25 112.817 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.5 mt -66.68 -21.07 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 114.347 1.24 . . . . 121.25 114.347 -165.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -63.4 -16.45 60.54 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.118 1.155 . . . . 121.25 114.118 170.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.103 0 CA-C-O 121.009 0.433 . . . . 121.25 110.204 164.05 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' THR . . . . . 0.443 HG23 ' HG ' ' B' ' 5' ' ' IYR . 5.5 t . . . . . 0 N--CA 1.504 2.232 0 N-CA-C 114.607 1.336 . . . . 121.25 114.607 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -49.99 -43.42 50.48 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.273 -0.892 . . . . 121.25 109.772 166.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -50.8 -42.91 58.54 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 112.59 0.589 . . . . 121.25 112.59 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.2 mt -63.24 -38.67 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 123.58 0.55 . . . . 121.25 111.93 172.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' IYR . . . . . 0.443 ' HG ' HG23 ' B' ' 1' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -54.23 -43.1 70.56 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.423 0.689 . . . . 121.25 112.703 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.5 -55.29 19.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.073 -0.512 . . . . 121.25 110.064 168.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.64 -36.07 71.35 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.378 0.881 . . . . 121.25 113.378 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.25 -54.84 14.86 Favored 'General case' 0 C--O 1.283 2.819 0 CA-C-O 121.515 0.674 . . . . 121.25 112.035 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -52.54 -45.25 66.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 114.389 -1.278 . . . . 121.25 111.109 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -54.11 -57.63 10.4 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.453 -0.794 . . . . 121.25 110.441 171.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.68 -49.54 47.17 Favored 'General case' 0 C--O 1.258 1.518 0 CA-C-O 121.198 0.523 . . . . 121.25 112.202 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -46.59 -44.15 17.9 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 113.905 1.076 . . . . 121.25 113.905 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.81 -39.81 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.07 -0.394 . . . . 121.25 111.558 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -65.79 -39.95 91.45 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 109.685 -0.487 . . . . 121.25 109.685 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -55.23 -48.44 73.91 Favored 'General case' 0 C--O 1.243 0.729 0 O-C-N 123.802 0.689 . . . . 121.25 110.157 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -65.19 -38.76 91.5 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 120.371 -0.532 . . . . 121.25 111.52 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 88.4 mt -56.87 -51.17 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 122.353 -0.217 . . . . 121.25 111.463 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.46 -47.68 83.22 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 119.286 -0.388 . . . . 121.25 110.147 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -41.12 -60.8 1.13 Allowed 'General case' 0 C--O 1.267 1.975 0 O-C-N 124.776 1.298 . . . . 121.25 108.253 170.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -56.47 -45.15 81.05 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.865 -1.061 . . . . 121.25 113.128 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.14 -51.22 70.97 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 113.055 0.761 . . . . 121.25 113.055 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 5.4 ptt-85 -62.93 -49.05 76.31 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 107.547 -1.279 . . . . 121.25 107.547 178.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -46.11 -40.97 11.74 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 113.414 0.894 . . . . 121.25 113.414 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tt -66.24 -41.57 89.82 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.003 0.742 . . . . 121.25 113.003 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 47.0 mt -66.71 -20.39 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 113.756 1.021 . . . . 121.25 113.756 -164.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -62.41 -17.95 60.46 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.66 0.985 . . . . 121.25 113.66 170.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 122.44 0.296 . . . . 121.25 110.594 164.699 . . . . . . . . 0 0 . 1 stop_ save_