data_5d48_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 5d48 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' -4' ' ' ARG . . . . . 0.564 ' NH2' ' CG ' ' A' ' -4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 114.619 1.34 . . . . 118.54 114.619 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . -98.24 -154.43 29.15 Favored Glycine 0 C--O 1.2 -2.007 0 N-CA-C 106.41 -2.676 . . . . 78.81 106.41 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.61 150.55 43.89 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.376 1.47 . . . . 69.2 114.942 179.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . 0.341 7.2 t-80 -113.56 155.98 24.44 Favored 'General case' 0 CA--C 1.492 -1.267 1 N-CA-C 97.237 -5.097 . . . . 69.85 97.237 177.485 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -65.29 -28.95 69.68 Favored 'General case' 0 N--CA 1.417 -2.091 0 C-N-CA 117.575 -1.65 . . . . 35.94 113.764 159.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -59.13 -31.46 68.97 Favored 'General case' 0 C--O 1.173 -2.951 0 N-CA-C 108.397 -0.964 . . . . 51.84 108.397 178.222 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . 0.29 13.8 m-20 -54.76 14.17 0.0 OUTLIER 'General case' 0 C--O 1.179 -2.608 0 C-N-CA 117.928 -1.509 . . . . 48.71 113.899 171.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 1' ' ' CYS . . . -89.71 -14.51 34.54 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 127.455 2.302 . . . . 36.35 114.088 159.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -99.36 -21.38 16.04 Favored 'General case' 0 C--O 1.168 -3.2 0 CA-C-N 114.481 -1.236 . . . . 20.46 109.401 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.9 134.85 27.92 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.296 0 C-N-CA 120.216 -0.594 . . . . 19.1 112.471 -171.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.12 -150.99 22.23 Favored Glycine 0 C--O 1.171 -3.785 0 N-CA-C 115.59 0.996 . . . . 19.78 115.59 171.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 m -126.63 126.48 43.66 Favored 'General case' 0 C--O 1.184 -2.387 0 N-CA-C 111.842 0.312 . . . . 27.74 111.842 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -122.85 140.41 52.98 Favored 'General case' 0 C--O 1.186 -2.268 0 O-C-N 125.484 1.74 . . . . 19.08 111.842 -167.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 pttt -123.12 136.47 54.8 Favored 'General case' 0 C--O 1.156 -3.852 0 CA-C-O 122.313 1.054 . . . . 36.09 110.714 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 tp -68.55 129.1 38.93 Favored 'General case' 0 C--O 1.176 -2.785 0 O-C-N 121.224 -0.922 . . . . 18.29 110.723 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 15.1 m -117.74 -19.34 6.09 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 N-CA-C 116.093 1.886 . . . . 21.68 116.093 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.0 p -152.33 153.6 33.99 Favored 'General case' 0 C--O 1.168 -3.233 0 N-CA-C 115.771 1.767 . . . . 26.81 115.771 168.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.1 t -138.04 134.66 35.04 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 124.33 1.019 . . . . 22.03 109.345 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -130.91 136.16 48.34 Favored 'General case' 0 C--O 1.194 -1.826 0 N-CA-C 108.869 -0.789 . . . . 29.41 108.869 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . 0.404 ' ND2' ' O ' ' A' ' 308' ' ' HOH . 34.7 m120 61.58 20.55 11.36 Favored 'General case' 0 C--O 1.172 -3.002 0 N-CA-C 115.153 1.538 . . . . 21.47 115.153 171.683 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -65.34 -38.01 88.82 Favored 'General case' 0 C--O 1.185 -2.34 0 N-CA-C 113.445 0.905 . . . . 18.51 113.445 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.51 -39.72 94.31 Favored 'General case' 0 C--O 1.183 -2.42 0 C-N-CA 119.406 -0.918 . . . . 26.92 109.351 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.61 -39.04 81.02 Favored 'General case' 0 C--O 1.189 -2.101 0 N-CA-C 109.158 -0.682 . . . . 39.57 109.158 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -60.66 -49.32 77.98 Favored 'General case' 0 C--O 1.179 -2.638 0 N-CA-C 106.633 -1.617 . . . . 16.88 106.633 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.7 mtm -59.03 -43.75 91.66 Favored 'General case' 0 C--O 1.158 -3.73 0 N-CA-C 113.677 0.991 . . . . 14.85 113.677 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -57.94 -40.56 80.79 Favored 'General case' 0 C--O 1.165 -3.349 0 C-N-CA 118.962 -1.095 . . . . 27.92 109.952 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.26 -32.69 73.04 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-O 121.646 0.736 . . . . 39.05 111.938 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.49 -31.7 53.89 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.67 0 CA-C-N 115.17 -0.923 . . . . 20.61 112.536 172.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.17 11.5 15.75 Favored Glycine 0 C--O 1.185 -2.921 0 N-CA-C 115.52 0.968 . . . . 21.53 115.52 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.71 133.3 32.03 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.491 0 C-N-CA 120.434 -0.507 . . . . 17.2 110.445 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.95 155.46 38.41 Favored Glycine 0 C--O 1.176 -3.471 0 O-C-N 124.703 1.252 . . . . 19.85 114.572 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -50.65 -56.45 11.79 Favored 'General case' 0 C--O 1.155 -3.873 0 N-CA-C 113.87 1.063 . . . . 19.5 113.87 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.49 -45.44 94.24 Favored 'General case' 0 C--O 1.172 -3.007 0 CA-C-O 121.847 0.832 . . . . 16.4 110.91 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.2 m -61.65 -39.91 93.04 Favored 'General case' 0 C--O 1.157 -3.809 0 CA-C-N 115.852 -0.613 . . . . 18.04 112.446 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -60.65 -41.08 94.26 Favored 'General case' 0 C--O 1.183 -2.402 0 CA-C-N 118.657 0.662 . . . . 17.31 111.518 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -65.95 -47.09 75.8 Favored 'General case' 0 C--O 1.194 -1.845 0 CA-C-N 115.699 -0.682 . . . . 27.42 110.618 -177.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 77.3 t -73.69 -38.33 51.15 Favored 'Isoleucine or valine' 0 C--O 1.177 -2.739 0 CA-C-N 115.385 -0.825 . . . . 17.81 112.439 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.19 94.39 Favored 'General case' 0 C--O 1.156 -3.818 0 N-CA-C 115.87 1.804 . . . . 16.24 115.87 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 -17.18 74.65 Favored Glycine 1 C--O 1.159 -4.587 0 CA-C-O 121.746 0.637 . . . . 16.3 114.058 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 86.7 mmm -80.0 -26.87 39.71 Favored 'General case' 0 C--O 1.157 -3.8 0 O-C-N 121.826 -0.808 . . . . 19.42 113.162 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.03 144.42 57.11 Favored 'General case' 0 C--O 1.171 -3.075 0 N-CA-C 114.264 1.209 . . . . 16.36 114.264 -174.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -121.81 71.75 30.53 Favored Pre-proline 0 C--O 1.173 -2.923 0 CA-C-O 122.655 1.217 . . . . 46.48 107.915 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -63.08 151.62 83.81 Favored 'Trans proline' 0 C--O 1.16 -3.425 0 N-CA-C 113.92 0.7 . . . . 16.43 113.92 -175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -89.19 151.54 22.11 Favored 'General case' 0 C--O 1.172 -2.987 0 O-C-N 126.08 2.113 . . . . 27.43 110.635 153.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.4 ttp -128.71 128.64 44.46 Favored 'General case' 0 C--O 1.196 -1.734 0 N-CA-C 107.962 -1.125 . . . . 17.29 107.962 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.25 126.41 72.81 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.354 0 N-CA-C 106.968 -1.493 . . . . 24.86 106.968 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -123.74 129.15 74.6 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.241 0 O-C-N 123.547 0.53 . . . . 16.52 109.893 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 p -142.46 158.42 43.7 Favored 'General case' 0 C--O 1.18 -2.579 0 N-CA-C 109.368 -0.604 . . . . 24.51 109.368 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.4 t -129.28 139.54 51.52 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.171 0 O-C-N 124.757 1.286 . . . . 19.98 108.358 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -144.4 103.16 3.93 Favored 'General case' 0 C--O 1.174 -2.918 0 N-CA-C 105.341 -2.096 . . . . 18.67 105.341 178.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 57.31 -120.59 21.82 Favored Glycine 0 C--O 1.185 -2.937 0 CA-C-N 115.623 -0.717 . . . . 23.39 111.624 -168.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -90.93 -2.29 57.74 Favored 'General case' 0 C--O 1.175 -2.848 0 N-CA-C 113.309 0.855 . . . . 35.71 113.309 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -99.54 123.45 52.29 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.164 0 CA-C-O 119.295 -0.383 . . . . 17.87 111.511 -172.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 67.3 mt -102.18 135.31 39.76 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.3 0 N-CA-C 106.68 -1.6 . . . . 16.71 106.68 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.7 m -118.76 132.14 56.14 Favored 'General case' 0 C--O 1.176 -2.767 0 CA-C-O 120.965 0.412 . . . . 15.48 110.114 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 53.7 mt -124.37 127.79 73.34 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.916 0 O-C-N 125.104 1.503 . . . . 15.66 108.82 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -123.53 148.99 45.76 Favored 'General case' 0 C--O 1.186 -2.255 0 O-C-N 124.872 1.357 . . . . 50.71 111.655 176.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 94.0 p -111.76 145.68 38.92 Favored 'General case' 0 C--O 1.171 -3.034 0 O-C-N 125.678 1.861 . . . . 19.34 108.227 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -126.18 109.43 12.33 Favored 'General case' 0 C--O 1.193 -1.882 0 N-CA-C 102.907 -2.997 . . . . 60.35 102.907 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.7 t -150.54 147.34 27.35 Favored 'General case' 0 C--O 1.174 -2.896 0 C-N-CA 119.489 -0.884 . . . . 20.68 111.676 -167.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.5 p -68.78 -13.58 62.49 Favored 'General case' 0 C--O 1.185 -2.305 0 N-CA-C 113.251 0.834 . . . . 26.0 113.251 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -89.18 -49.27 6.84 Favored 'General case' 0 C--O 1.173 -2.96 0 C-N-CA 120.34 -0.544 . . . . 23.68 111.776 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.59 125.08 1.19 Allowed 'General case' 0 C--O 1.196 -1.712 0 CA-C-O 121.527 0.68 . . . . 41.56 111.668 -175.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -92.07 115.7 28.29 Favored 'General case' 0 C--O 1.178 -2.697 0 CA-C-N 114.254 -1.339 . . . . 26.54 108.983 172.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.4 p -133.69 169.48 16.96 Favored 'General case' 0 C--O 1.183 -2.401 0 C-N-CA 124.47 1.108 . . . . 23.38 112.561 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -151.58 144.62 24.56 Favored 'General case' 0 C--O 1.183 -2.415 0 C-N-CA 119.842 -0.743 . . . . 36.47 109.665 174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.5 pt -126.8 138.59 54.33 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.209 0 O-C-N 124.781 1.3 . . . . 13.93 110.326 170.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 60.1 m -124.16 137.94 54.48 Favored 'General case' 0 C--O 1.172 -3.02 0 CA-C-N 114.051 -1.431 . . . . 16.26 110.339 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -160.15 160.48 32.96 Favored 'General case' 0 C--O 1.162 -3.545 0 N-CA-C 114.44 1.274 . . . . 14.3 114.44 -170.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.5 mt -110.42 134.95 50.99 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.957 0 N-CA-C 107.89 -1.152 . . . . 15.52 107.89 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.7 mt -57.1 132.39 52.77 Favored 'General case' 0 C--O 1.171 -3.048 0 N-CA-C 108.268 -1.012 . . . . 19.87 108.268 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.6 -3.41 86.69 Favored Glycine 0 C--O 1.177 -3.409 0 O-C-N 125.046 1.466 . . . . 15.45 115.951 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -110.11 119.28 38.78 Favored 'General case' 0 C--O 1.176 -2.792 0 CA-C-N 117.164 0.482 . . . . 24.48 111.637 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.74 141.02 58.48 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.197 0.31 . . . . 36.54 110.604 -173.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -135.56 164.69 27.25 Favored 'General case' 0 C--O 1.179 -2.644 0 O-C-N 125.719 1.887 . . . . 14.23 115.217 173.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -89.87 139.58 30.45 Favored 'General case' 0 C--O 1.16 -3.611 0 N-CA-C 108.47 -0.937 . . . . 25.54 108.47 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -139.2 135.4 33.92 Favored 'General case' 0 C--O 1.164 -3.427 0 N-CA-C 109.143 -0.688 . . . . 22.54 109.143 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.47 113.5 41.62 Favored 'Isoleucine or valine' 1 C--O 1.145 -4.409 0 N-CA-C 104.818 -2.289 . . . . 24.52 104.818 170.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 53.1 p -73.74 166.47 23.25 Favored 'General case' 1 C--O 1.151 -4.094 0 CA-C-O 121.105 0.479 . . . . 19.59 112.023 -176.176 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.14 -35.74 67.47 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 113.463 0.912 . . . . 22.82 113.463 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -84.98 12.49 7.46 Favored 'General case' 0 C--O 1.177 -2.731 0 N-CA-C 114.53 1.307 . . . . 23.09 114.53 174.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.272 63.6 m-20 68.09 27.09 7.03 Favored 'General case' 0 C--O 1.187 -2.222 0 N-CA-C 115.768 1.766 . . . . 35.08 115.768 173.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -76.81 138.44 39.85 Favored 'General case' 0 C--O 1.194 -1.86 0 O-C-N 121.925 -0.485 . . . . 21.1 110.085 161.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -97.44 113.28 24.93 Favored 'General case' 0 C--O 1.154 -3.927 0 N-CA-C 106.51 -1.663 . . . . 24.4 106.51 169.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 9.5 m -126.07 164.3 26.13 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.133 0 N-CA-C 111.851 0.315 . . . . 18.01 111.851 -174.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -105.39 126.71 52.42 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.093 -1.077 . . . . 35.83 108.093 168.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -120.12 149.37 42.32 Favored 'General case' 0 C--O 1.158 -3.732 0 O-C-N 124.927 1.392 . . . . 16.04 113.782 -173.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -139.04 132.39 30.07 Favored 'General case' 0 C--O 1.184 -2.365 0 N-CA-C 108.574 -0.899 . . . . 17.46 108.574 171.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 68.5 mt -117.72 126.94 75.09 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.06 0 CA-C-N 114.586 -1.188 . . . . 14.78 109.723 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.3 p -126.05 165.3 19.08 Favored 'General case' 0 C--O 1.169 -3.15 0 C-N-CA 124.731 1.212 . . . . 17.86 110.896 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.11 111.87 23.09 Favored 'General case' 0 C--O 1.194 -1.854 0 N-CA-C 106.525 -1.657 . . . . 27.89 106.525 176.525 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -109.12 93.31 4.45 Favored 'General case' 0 N--CA 1.423 -1.815 0 N-CA-C 105.918 -1.882 . . . . 55.67 105.918 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 42.56 69.04 0.65 Allowed Glycine 0 C--O 1.209 -1.434 0 CA-C-N 114.558 -1.201 . . . . 35.19 115.66 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.3 -19.38 27.58 Favored Glycine 0 C--N 1.287 -2.189 0 C-N-CA 115.002 -3.475 . . . . 25.31 118.761 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.45 131.52 54.6 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.398 0 N-CA-C 109.492 -0.558 . . . . 21.48 109.492 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.9 mt -88.12 122.84 32.16 Favored 'General case' 0 C--O 1.179 -2.619 0 N-CA-C 107.559 -1.274 . . . . 22.09 107.559 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.4 t -113.22 118.72 58.84 Favored 'Isoleucine or valine' 0 C--O 1.154 -3.957 0 O-C-N 124.729 1.268 . . . . 18.19 108.923 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -117.2 110.25 17.91 Favored 'General case' 0 C--O 1.189 -2.13 0 O-C-N 124.546 1.154 . . . . 14.67 108.521 -173.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 43.2 t -108.58 125.8 65.44 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.69 0 CA-C-O 119.019 -0.515 . . . . 17.42 110.44 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -112.59 131.87 55.41 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 124.818 1.324 . . . . 16.7 111.212 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -125.98 134.66 51.43 Favored 'General case' 0 C--O 1.162 -3.536 0 O-C-N 124.362 1.039 . . . . 40.26 110.549 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TRP . . . . . 0.419 ' O ' ' N ' ' A' ' 100' ' ' LYS . 4.1 p90 -162.21 144.64 11.26 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 125.103 1.502 . . . . 22.45 110.724 177.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 42.65 42.11 2.71 Favored 'General case' 0 C--O 1.173 -2.921 0 CA-C-N 113.188 -1.824 . . . . 30.55 111.488 175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.84 12.87 65.45 Favored Glycine 0 C--O 1.198 -2.118 0 N-CA-C 117.868 1.907 . . . . 32.2 117.868 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 97' ' ' TRP . 24.6 mttt -109.14 168.32 9.46 Favored 'General case' 0 C--O 1.183 -2.442 0 C-N-CA 123.607 0.763 . . . . 48.63 109.055 174.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.3 155.28 33.46 Favored 'General case' 0 C--O 1.169 -3.166 0 CA-C-N 114.652 -1.158 . . . . 27.98 111.272 171.475 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -143.79 151.31 39.79 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 106.586 -1.635 . . . . 16.12 106.586 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.0 m -128.88 131.62 47.65 Favored 'General case' 0 C--O 1.183 -2.421 0 CA-C-N 114.839 -1.073 . . . . 17.48 109.365 -175.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 63.5 mt -118.67 120.77 65.18 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.915 0 N-CA-C 106.922 -1.511 . . . . 21.81 106.922 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -112.22 137.87 49.72 Favored 'General case' 0 C--O 1.173 -2.945 0 N-CA-C 107.261 -1.385 . . . . 32.58 107.261 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.6 mtt85 -130.27 127.34 39.34 Favored 'General case' 0 C--O 1.164 -3.421 0 N-CA-C 109.307 -0.627 . . . . 18.02 109.307 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -150.2 153.67 36.65 Favored 'General case' 0 C--O 1.184 -2.378 0 C-N-CA 119.299 -0.961 . . . . 22.52 111.96 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -84.85 127.41 34.13 Favored 'General case' 0 C--O 1.182 -2.499 0 O-C-N 124.802 1.314 . . . . 23.43 111.165 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -135.92 121.14 19.03 Favored 'General case' 0 C--O 1.161 -3.589 0 C-N-CA 119.169 -1.012 . . . . 47.94 110.355 169.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.56 -135.83 1.44 Allowed 'General case' 0 C--O 1.191 -1.991 0 N-CA-C 106.738 -1.579 . . . . 27.28 106.738 -171.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -89.83 16.58 7.85 Favored 'General case' 0 C--O 1.193 -1.89 0 N-CA-C 114.597 1.332 . . . . 21.66 114.597 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.27 154.13 23.87 Favored 'General case' 0 C--O 1.164 -3.436 0 CA-C-N 115.221 -0.9 . . . . 20.58 111.789 -178.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.8 tt -112.45 115.01 28.0 Favored 'General case' 0 C--O 1.183 -2.418 0 N-CA-C 105.85 -1.907 . . . . 21.54 105.85 167.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.6 t -100.7 127.7 53.55 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.788 0 CA-C-N 113.833 -1.531 . . . . 16.92 109.743 -173.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.8 t -115.78 120.25 64.22 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.289 0 CA-C-O 118.304 -0.855 . . . . 15.53 109.783 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -112.59 119.85 39.55 Favored 'General case' 0 C--O 1.183 -2.439 0 N-CA-C 105.635 -1.987 . . . . 25.47 105.635 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 34.0 m -104.71 125.75 51.11 Favored 'General case' 0 C--O 1.196 -1.724 0 O-C-N 124.046 0.841 . . . . 19.55 109.542 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.4 t -125.0 129.7 73.34 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.246 0 CA-C-N 115.074 -0.966 . . . . 19.62 113.602 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 16.0 tpt -137.38 105.45 5.68 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 107.285 -1.376 . . . . 21.34 107.285 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? 61.69 -113.4 0.51 Allowed 'General case' 0 C--O 1.19 -2.058 0 N-CA-C 105.578 -2.008 . . . . 22.4 105.578 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.79 5.04 56.47 Favored Glycine 0 C--O 1.178 -3.357 0 C-N-CA 118.82 -1.657 . . . . 14.72 115.805 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 56.0 t -103.96 129.13 56.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.855 0 C-N-CA 119.044 -1.062 . . . . 23.48 111.186 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 55.6 m -116.24 135.2 54.11 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 114.021 1.119 . . . . 23.08 114.021 175.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 42.2 t -114.86 133.14 56.21 Favored 'General case' 0 C--O 1.188 -2.162 0 CA-C-N 115.567 -0.742 . . . . 16.43 112.548 170.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 25.5 m -108.93 121.85 45.97 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-O 121.002 0.429 . . . . 18.74 111.514 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.4 mtp85 -120.67 119.67 33.49 Favored 'General case' 0 N--CA 1.416 -2.161 0 CA-C-N 115.075 -0.966 . . . . 26.77 110.875 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.2 t -107.68 126.65 64.05 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.888 0 O-C-N 124.443 1.089 . . . . 16.03 111.508 -171.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -113.71 146.39 39.92 Favored 'General case' 0 C--O 1.182 -2.493 0 O-C-N 123.925 0.765 . . . . 15.69 112.314 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -121.2 164.26 17.2 Favored 'General case' 0 C--O 1.159 -3.664 0 C-N-CA 124.646 1.178 . . . . 24.22 109.339 170.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.6 mtt-85 -64.46 140.71 58.9 Favored 'General case' 0 C--O 1.183 -2.413 0 CA-C-O 121.595 0.712 . . . . 24.92 111.778 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.595 0 CA-C-O 118.377 -0.82 . . . . 36.92 111.559 -178.106 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' L96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . 0.404 ' O ' ' ND2' ' A' ' 15' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -4' ' ' ARG . . . . . 0.841 HH21 ' HG2' ' A' ' -4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 114.619 1.34 . . . . 118.54000000000001 114.619 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . -98.24 -154.43 29.15 Favored Glycine 0 C--O 1.2 -2.007 0 N-CA-C 106.41 -2.676 . . . . 78.810000000000002 106.41 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.61 150.55 43.89 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.376 1.47 . . . . 69.200000000000003 114.942 179.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' -1' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 1' ' ' CYS 0.341 7.2 t-80 -113.56 155.98 24.44 Favored 'General case' 0 CA--C 1.492 -1.267 1 N-CA-C 97.237 -5.097 . . . . 69.849999999999994 97.237 177.485 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -65.29 -28.95 69.68 Favored 'General case' 0 N--CA 1.417 -2.091 0 C-N-CA 117.575 -1.65 . . . . 35.939999999999998 113.764 159.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' ND1' ' A' ' -1' ' ' HIS . 0.0 OUTLIER -59.13 -31.46 68.97 Favored 'General case' 0 C--O 1.173 -2.951 0 N-CA-C 108.397 -0.964 . . . . 51.840000000000003 108.397 178.222 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASP . . . . . 0.422 ' H ' ' HB3' ' A' ' -1' ' ' HIS 0.29 13.8 m-20 -54.76 14.17 0.0 OUTLIER 'General case' 0 C--O 1.179 -2.608 0 C-N-CA 117.928 -1.509 . . . . 48.710000000000001 113.899 171.21 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 1' ' ' CYS . . . -89.71 -14.51 34.54 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 127.455 2.302 . . . . 36.350000000000001 114.088 159.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -99.36 -21.38 16.04 Favored 'General case' 0 C--O 1.168 -3.2 0 CA-C-N 114.481 -1.236 . . . . 20.460000000000001 109.401 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.9 134.85 27.92 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.296 0 C-N-CA 120.216 -0.594 . . . . 19.100000000000001 112.471 -171.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.12 -150.99 22.23 Favored Glycine 0 C--O 1.171 -3.785 0 N-CA-C 115.59 0.996 . . . . 19.780000000000001 115.59 171.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 m -126.63 126.48 43.66 Favored 'General case' 0 C--O 1.184 -2.387 0 N-CA-C 111.842 0.312 . . . . 27.739999999999998 111.842 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -122.85 140.41 52.98 Favored 'General case' 0 C--O 1.186 -2.268 0 O-C-N 125.484 1.74 . . . . 19.079999999999998 111.842 -167.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 pttt -123.12 136.47 54.8 Favored 'General case' 0 C--O 1.156 -3.852 0 CA-C-O 122.313 1.054 . . . . 36.090000000000003 110.714 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 tp -68.55 129.1 38.93 Favored 'General case' 0 C--O 1.176 -2.785 0 O-C-N 121.224 -0.922 . . . . 18.289999999999999 110.723 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 15.1 m -117.74 -19.34 6.09 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 N-CA-C 116.093 1.886 . . . . 21.68 116.093 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.0 p -152.33 153.6 33.99 Favored 'General case' 0 C--O 1.168 -3.233 0 N-CA-C 115.771 1.767 . . . . 26.809999999999999 115.771 168.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.1 t -138.04 134.66 35.04 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 124.33 1.019 . . . . 22.030000000000001 109.345 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -130.91 136.16 48.34 Favored 'General case' 0 C--O 1.194 -1.826 0 N-CA-C 108.869 -0.789 . . . . 29.41 108.869 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m120 61.58 20.55 11.36 Favored 'General case' 0 C--O 1.172 -3.002 0 N-CA-C 115.153 1.538 . . . . 21.469999999999999 115.153 171.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -65.34 -38.01 88.82 Favored 'General case' 0 C--O 1.185 -2.34 0 N-CA-C 113.445 0.905 . . . . 18.510000000000002 113.445 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.51 -39.72 94.31 Favored 'General case' 0 C--O 1.183 -2.42 0 C-N-CA 119.406 -0.918 . . . . 26.920000000000002 109.351 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.61 -39.04 81.02 Favored 'General case' 0 C--O 1.189 -2.101 0 N-CA-C 109.158 -0.682 . . . . 39.57 109.158 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -60.66 -49.32 77.98 Favored 'General case' 0 C--O 1.179 -2.638 0 N-CA-C 106.633 -1.617 . . . . 16.879999999999999 106.633 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.7 mtm -59.03 -43.75 91.66 Favored 'General case' 0 C--O 1.158 -3.73 0 N-CA-C 113.677 0.991 . . . . 14.85 113.677 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -57.94 -40.56 80.79 Favored 'General case' 0 C--O 1.165 -3.349 0 C-N-CA 118.962 -1.095 . . . . 27.920000000000002 109.952 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.26 -32.69 73.04 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-O 121.646 0.736 . . . . 39.049999999999997 111.938 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.49 -31.7 53.89 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.67 0 CA-C-N 115.17 -0.923 . . . . 20.609999999999999 112.536 172.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.17 11.5 15.75 Favored Glycine 0 C--O 1.185 -2.921 0 N-CA-C 115.52 0.968 . . . . 21.530000000000001 115.52 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.71 133.3 32.03 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.491 0 C-N-CA 120.434 -0.507 . . . . 17.199999999999999 110.445 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.95 155.46 38.41 Favored Glycine 0 C--O 1.176 -3.471 0 O-C-N 124.703 1.252 . . . . 19.850000000000001 114.572 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -50.65 -56.45 11.79 Favored 'General case' 0 C--O 1.155 -3.873 0 N-CA-C 113.87 1.063 . . . . 19.5 113.87 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.49 -45.44 94.24 Favored 'General case' 0 C--O 1.172 -3.007 0 CA-C-O 121.847 0.832 . . . . 16.399999999999999 110.91 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.2 m -61.65 -39.91 93.04 Favored 'General case' 0 C--O 1.157 -3.809 0 CA-C-N 115.852 -0.613 . . . . 18.039999999999999 112.446 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -60.65 -41.08 94.26 Favored 'General case' 0 C--O 1.183 -2.402 0 CA-C-N 118.657 0.662 . . . . 17.309999999999999 111.518 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -65.95 -47.09 75.8 Favored 'General case' 0 C--O 1.194 -1.845 0 CA-C-N 115.699 -0.682 . . . . 27.420000000000002 110.618 -177.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 77.3 t -73.69 -38.33 51.15 Favored 'Isoleucine or valine' 0 C--O 1.177 -2.739 0 CA-C-N 115.385 -0.825 . . . . 17.809999999999999 112.439 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.19 94.39 Favored 'General case' 0 C--O 1.156 -3.818 0 N-CA-C 115.87 1.804 . . . . 16.239999999999998 115.87 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 -17.18 74.65 Favored Glycine 1 C--O 1.159 -4.587 0 CA-C-O 121.746 0.637 . . . . 16.300000000000001 114.058 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 86.7 mmm -80.0 -26.87 39.71 Favored 'General case' 0 C--O 1.157 -3.8 0 O-C-N 121.826 -0.808 . . . . 19.420000000000002 113.162 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.03 144.42 57.11 Favored 'General case' 0 C--O 1.171 -3.075 0 N-CA-C 114.264 1.209 . . . . 16.359999999999999 114.264 -174.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -121.81 71.75 30.53 Favored Pre-proline 0 C--O 1.173 -2.923 0 CA-C-O 122.655 1.217 . . . . 46.479999999999997 107.915 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . 0.445 ' HB3' ' HB2' ' A' ' 55' ' ' SER . 36.5 Cg_endo -63.08 151.62 83.81 Favored 'Trans proline' 0 C--O 1.16 -3.425 0 N-CA-C 113.92 0.7 . . . . 16.43 113.92 -175.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -89.19 151.54 22.11 Favored 'General case' 0 C--O 1.172 -2.987 0 O-C-N 126.08 2.113 . . . . 27.43 110.635 153.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.4 ttp -128.71 128.64 44.46 Favored 'General case' 0 C--O 1.196 -1.734 0 N-CA-C 107.962 -1.125 . . . . 17.289999999999999 107.962 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.25 126.41 72.81 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.354 0 N-CA-C 106.968 -1.493 . . . . 24.859999999999999 106.968 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -123.74 129.15 74.6 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.241 0 O-C-N 123.547 0.53 . . . . 16.52 109.893 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 p -142.46 158.42 43.7 Favored 'General case' 0 C--O 1.18 -2.579 0 N-CA-C 109.368 -0.604 . . . . 24.510000000000002 109.368 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.4 t -129.28 139.54 51.52 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.171 0 O-C-N 124.757 1.286 . . . . 19.98 108.358 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -144.4 103.16 3.93 Favored 'General case' 0 C--O 1.174 -2.918 0 N-CA-C 105.341 -2.096 . . . . 18.670000000000002 105.341 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 57.31 -120.59 21.82 Favored Glycine 0 C--O 1.185 -2.937 0 CA-C-N 115.623 -0.717 . . . . 23.390000000000001 111.624 -168.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -90.93 -2.29 57.74 Favored 'General case' 0 C--O 1.175 -2.848 0 N-CA-C 113.309 0.855 . . . . 35.710000000000001 113.309 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -99.54 123.45 52.29 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.164 0 CA-C-O 119.295 -0.383 . . . . 17.870000000000001 111.511 -172.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 67.3 mt -102.18 135.31 39.76 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.3 0 N-CA-C 106.68 -1.6 . . . . 16.710000000000001 106.68 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.7 m -118.76 132.14 56.14 Favored 'General case' 0 C--O 1.176 -2.767 0 CA-C-O 120.965 0.412 . . . . 15.48 110.114 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 53.7 mt -124.37 127.79 73.34 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.916 0 O-C-N 125.104 1.503 . . . . 15.66 108.82 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HE2' ' OE2' ' A' ' 61' ' ' GLU . 13.2 mttt -123.53 148.99 45.76 Favored 'General case' 0 C--O 1.186 -2.255 0 O-C-N 124.872 1.357 . . . . 50.710000000000001 111.655 176.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 94.0 p -111.76 145.68 38.92 Favored 'General case' 0 C--O 1.171 -3.034 0 O-C-N 125.678 1.861 . . . . 19.34 108.227 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -126.18 109.43 12.33 Favored 'General case' 0 C--O 1.193 -1.882 0 N-CA-C 102.907 -2.997 . . . . 60.350000000000001 102.907 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 38' ' ' PRO . 3.7 t -150.54 147.34 27.35 Favored 'General case' 0 C--O 1.174 -2.896 0 C-N-CA 119.489 -0.884 . . . . 20.68 111.676 -167.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.5 p -68.78 -13.58 62.49 Favored 'General case' 0 C--O 1.185 -2.305 0 N-CA-C 113.251 0.834 . . . . 26.0 113.251 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -89.18 -49.27 6.84 Favored 'General case' 0 C--O 1.173 -2.96 0 C-N-CA 120.34 -0.544 . . . . 23.68 111.776 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -167.59 125.08 1.19 Allowed 'General case' 0 C--O 1.196 -1.712 0 CA-C-O 121.527 0.68 . . . . 41.560000000000002 111.668 -175.054 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -92.07 115.7 28.29 Favored 'General case' 0 C--O 1.178 -2.697 0 CA-C-N 114.254 -1.339 . . . . 26.539999999999999 108.983 172.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.4 p -133.69 169.48 16.96 Favored 'General case' 0 C--O 1.183 -2.401 0 C-N-CA 124.47 1.108 . . . . 23.379999999999999 112.561 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.711 ' OE2' ' HE2' ' A' ' 52' ' ' LYS . 6.5 tt0 -151.58 144.62 24.56 Favored 'General case' 0 C--O 1.183 -2.415 0 C-N-CA 119.842 -0.743 . . . . 36.469999999999999 109.665 174.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.5 pt -126.8 138.59 54.33 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.209 0 O-C-N 124.781 1.3 . . . . 13.93 110.326 170.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 60.1 m -124.16 137.94 54.48 Favored 'General case' 0 C--O 1.172 -3.02 0 CA-C-N 114.051 -1.431 . . . . 16.260000000000002 110.339 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -160.15 160.48 32.96 Favored 'General case' 0 C--O 1.162 -3.545 0 N-CA-C 114.44 1.274 . . . . 14.300000000000001 114.44 -170.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.5 mt -110.42 134.95 50.99 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.957 0 N-CA-C 107.89 -1.152 . . . . 15.52 107.89 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.7 mt -57.1 132.39 52.77 Favored 'General case' 0 C--O 1.171 -3.048 0 N-CA-C 108.268 -1.012 . . . . 19.870000000000001 108.268 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.6 -3.41 86.69 Favored Glycine 0 C--O 1.177 -3.409 0 O-C-N 125.046 1.466 . . . . 15.449999999999999 115.951 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -110.11 119.28 38.78 Favored 'General case' 0 C--O 1.176 -2.792 0 CA-C-N 117.164 0.482 . . . . 24.48 111.637 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.74 141.02 58.48 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.197 0.31 . . . . 36.539999999999999 110.604 -173.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -135.56 164.69 27.25 Favored 'General case' 0 C--O 1.179 -2.644 0 O-C-N 125.719 1.887 . . . . 14.23 115.217 173.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -89.87 139.58 30.45 Favored 'General case' 0 C--O 1.16 -3.611 0 N-CA-C 108.47 -0.937 . . . . 25.539999999999999 108.47 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -139.2 135.4 33.92 Favored 'General case' 0 C--O 1.164 -3.427 0 N-CA-C 109.143 -0.688 . . . . 22.539999999999999 109.143 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.47 113.5 41.62 Favored 'Isoleucine or valine' 1 C--O 1.145 -4.409 0 N-CA-C 104.818 -2.289 . . . . 24.52 104.818 170.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 53.1 p -73.74 166.47 23.25 Favored 'General case' 1 C--O 1.151 -4.094 0 CA-C-O 121.105 0.479 . . . . 19.59 112.023 -176.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.14 -35.74 67.47 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 113.463 0.912 . . . . 22.82 113.463 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -84.98 12.49 7.46 Favored 'General case' 0 C--O 1.177 -2.731 0 N-CA-C 114.53 1.307 . . . . 23.09 114.53 174.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.272 63.6 m-20 68.09 27.09 7.03 Favored 'General case' 0 C--O 1.187 -2.222 0 N-CA-C 115.768 1.766 . . . . 35.079999999999998 115.768 173.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -76.81 138.44 39.85 Favored 'General case' 0 C--O 1.194 -1.86 0 O-C-N 121.925 -0.485 . . . . 21.100000000000001 110.085 161.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.491 ' HD2' ' N ' ' A' ' 79' ' ' LYS . 2.7 mptp? -97.44 113.28 24.93 Favored 'General case' 0 C--O 1.154 -3.927 0 N-CA-C 106.51 -1.663 . . . . 24.399999999999999 106.51 169.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 9.5 m -126.07 164.3 26.13 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.133 0 N-CA-C 111.851 0.315 . . . . 18.010000000000002 111.851 -174.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -105.39 126.71 52.42 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.093 -1.077 . . . . 35.829999999999998 108.093 168.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -120.12 149.37 42.32 Favored 'General case' 0 C--O 1.158 -3.732 0 O-C-N 124.927 1.392 . . . . 16.039999999999999 113.782 -173.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -139.04 132.39 30.07 Favored 'General case' 0 C--O 1.184 -2.365 0 N-CA-C 108.574 -0.899 . . . . 17.460000000000001 108.574 171.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 68.5 mt -117.72 126.94 75.09 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.06 0 CA-C-N 114.586 -1.188 . . . . 14.779999999999999 109.723 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.3 p -126.05 165.3 19.08 Favored 'General case' 0 C--O 1.169 -3.15 0 C-N-CA 124.731 1.212 . . . . 17.859999999999999 110.896 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.11 111.87 23.09 Favored 'General case' 0 C--O 1.194 -1.854 0 N-CA-C 106.525 -1.657 . . . . 27.890000000000001 106.525 176.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -109.12 93.31 4.45 Favored 'General case' 0 N--CA 1.423 -1.815 0 N-CA-C 105.918 -1.882 . . . . 55.670000000000002 105.918 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 42.56 69.04 0.65 Allowed Glycine 0 C--O 1.209 -1.434 0 CA-C-N 114.558 -1.201 . . . . 35.189999999999998 115.66 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.3 -19.38 27.58 Favored Glycine 0 C--N 1.287 -2.189 0 C-N-CA 115.002 -3.475 . . . . 25.309999999999999 118.761 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.45 131.52 54.6 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.398 0 N-CA-C 109.492 -0.558 . . . . 21.48 109.492 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.9 mt -88.12 122.84 32.16 Favored 'General case' 0 C--O 1.179 -2.619 0 N-CA-C 107.559 -1.274 . . . . 22.09 107.559 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.4 t -113.22 118.72 58.84 Favored 'Isoleucine or valine' 0 C--O 1.154 -3.957 0 O-C-N 124.729 1.268 . . . . 18.190000000000001 108.923 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -117.2 110.25 17.91 Favored 'General case' 0 C--O 1.189 -2.13 0 O-C-N 124.546 1.154 . . . . 14.67 108.521 -173.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 43.2 t -108.58 125.8 65.44 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.69 0 CA-C-O 119.019 -0.515 . . . . 17.420000000000002 110.44 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -112.59 131.87 55.41 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 124.818 1.324 . . . . 16.699999999999999 111.212 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -125.98 134.66 51.43 Favored 'General case' 0 C--O 1.162 -3.536 0 O-C-N 124.362 1.039 . . . . 40.259999999999998 110.549 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 4.1 p90 -162.21 144.64 11.26 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 125.103 1.502 . . . . 22.449999999999999 110.724 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 42.65 42.11 2.71 Favored 'General case' 0 C--O 1.173 -2.921 0 CA-C-N 113.188 -1.824 . . . . 30.550000000000001 111.488 175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.84 12.87 65.45 Favored Glycine 0 C--O 1.198 -2.118 0 N-CA-C 117.868 1.907 . . . . 32.200000000000003 117.868 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.605 ' HE3' ' O ' ' A' ' 359' ' ' HOH . 24.6 mttt -109.14 168.32 9.46 Favored 'General case' 0 C--O 1.183 -2.442 0 C-N-CA 123.607 0.763 . . . . 48.630000000000003 109.055 174.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.3 155.28 33.46 Favored 'General case' 0 C--O 1.169 -3.166 0 CA-C-N 114.652 -1.158 . . . . 27.98 111.272 171.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -143.79 151.31 39.79 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 106.586 -1.635 . . . . 16.120000000000001 106.586 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.0 m -128.88 131.62 47.65 Favored 'General case' 0 C--O 1.183 -2.421 0 CA-C-N 114.839 -1.073 . . . . 17.48 109.365 -175.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 63.5 mt -118.67 120.77 65.18 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.915 0 N-CA-C 106.922 -1.511 . . . . 21.809999999999999 106.922 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -112.22 137.87 49.72 Favored 'General case' 0 C--O 1.173 -2.945 0 N-CA-C 107.261 -1.385 . . . . 32.579999999999998 107.261 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.6 mtt85 -130.27 127.34 39.34 Favored 'General case' 0 C--O 1.164 -3.421 0 N-CA-C 109.307 -0.627 . . . . 18.02 109.307 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 107' ' ' LYS . 14.8 ptmt -150.2 153.67 36.65 Favored 'General case' 0 C--O 1.184 -2.378 0 C-N-CA 119.299 -0.961 . . . . 22.52 111.96 -178.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -84.85 127.41 34.13 Favored 'General case' 0 C--O 1.182 -2.499 0 O-C-N 124.802 1.314 . . . . 23.43 111.165 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -135.92 121.14 19.03 Favored 'General case' 0 C--O 1.161 -3.589 0 C-N-CA 119.169 -1.012 . . . . 47.939999999999998 110.355 169.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.56 -135.83 1.44 Allowed 'General case' 0 C--O 1.191 -1.991 0 N-CA-C 106.738 -1.579 . . . . 27.280000000000001 106.738 -171.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -89.83 16.58 7.85 Favored 'General case' 0 C--O 1.193 -1.89 0 N-CA-C 114.597 1.332 . . . . 21.66 114.597 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.27 154.13 23.87 Favored 'General case' 0 C--O 1.164 -3.436 0 CA-C-N 115.221 -0.9 . . . . 20.579999999999998 111.789 -178.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.8 tt -112.45 115.01 28.0 Favored 'General case' 0 C--O 1.183 -2.418 0 N-CA-C 105.85 -1.907 . . . . 21.539999999999999 105.85 167.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.6 t -100.7 127.7 53.55 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.788 0 CA-C-N 113.833 -1.531 . . . . 16.920000000000002 109.743 -173.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.8 t -115.78 120.25 64.22 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.289 0 CA-C-O 118.304 -0.855 . . . . 15.529999999999999 109.783 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . 0.445 ' HG3' ' CG2' ' A' ' 123' ' ' THR . 60.1 tt0 -112.59 119.85 39.55 Favored 'General case' 0 C--O 1.183 -2.439 0 N-CA-C 105.635 -1.987 . . . . 25.469999999999999 105.635 -177.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 34.0 m -104.71 125.75 51.11 Favored 'General case' 0 C--O 1.196 -1.724 0 O-C-N 124.046 0.841 . . . . 19.550000000000001 109.542 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.4 t -125.0 129.7 73.34 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.246 0 CA-C-N 115.074 -0.966 . . . . 19.620000000000001 113.602 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 16.0 tpt -137.38 105.45 5.68 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 107.285 -1.376 . . . . 21.34 107.285 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? 61.69 -113.4 0.51 Allowed 'General case' 0 C--O 1.19 -2.058 0 N-CA-C 105.578 -2.008 . . . . 22.399999999999999 105.578 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.79 5.04 56.47 Favored Glycine 0 C--O 1.178 -3.357 0 C-N-CA 118.82 -1.657 . . . . 14.720000000000001 115.805 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 56.0 t -103.96 129.13 56.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.855 0 C-N-CA 119.044 -1.062 . . . . 23.48 111.186 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . 0.445 ' CG2' ' HG3' ' A' ' 116' ' ' GLU . 55.6 m -116.24 135.2 54.11 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 114.021 1.119 . . . . 23.079999999999998 114.021 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 42.2 t -114.86 133.14 56.21 Favored 'General case' 0 C--O 1.188 -2.162 0 CA-C-N 115.567 -0.742 . . . . 16.43 112.548 170.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 25.5 m -108.93 121.85 45.97 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-O 121.002 0.429 . . . . 18.739999999999998 111.514 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.4 mtp85 -120.67 119.67 33.49 Favored 'General case' 0 N--CA 1.416 -2.161 0 CA-C-N 115.075 -0.966 . . . . 26.77 110.875 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.2 t -107.68 126.65 64.05 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.888 0 O-C-N 124.443 1.089 . . . . 16.030000000000001 111.508 -171.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -113.71 146.39 39.92 Favored 'General case' 0 C--O 1.182 -2.493 0 O-C-N 123.925 0.765 . . . . 15.69 112.314 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -121.2 164.26 17.2 Favored 'General case' 0 C--O 1.159 -3.664 0 C-N-CA 124.646 1.178 . . . . 24.219999999999999 109.339 170.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 130' ' ' ARG . 14.6 mtt-85 -64.46 140.71 58.9 Favored 'General case' 0 C--O 1.183 -2.413 0 CA-C-O 121.595 0.712 . . . . 24.920000000000002 111.778 -179.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.595 0 CA-C-O 118.377 -0.82 . . . . 36.920000000000002 111.559 -178.106 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' L96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 359' ' ' HOH . . . . . 0.605 ' O ' ' HE3' ' A' ' 100' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 369' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' ARG . . . . . 0.841 HH21 ' HG2' ' A' ' -4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 114.619 1.34 . . . . 118.54000000000001 114.619 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . -98.24 -154.43 29.15 Favored Glycine 0 C--O 1.2 -2.007 0 N-CA-C 106.41 -2.676 . . . . 78.810000000000002 106.41 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.61 150.55 43.89 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.376 1.47 . . . . 69.200000000000003 114.942 179.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' A' ' 1' ' ' CYS 0.341 7.2 t-80 -113.56 155.98 24.44 Favored 'General case' 0 CA--C 1.492 -1.267 1 N-CA-C 97.237 -5.097 . . . . 69.849999999999994 97.237 177.485 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -65.29 -28.95 69.68 Favored 'General case' 0 N--CA 1.417 -2.091 0 C-N-CA 117.575 -1.65 . . . . 35.939999999999998 113.764 159.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' ND1' ' A' ' -1' ' ' HIS . 0.0 OUTLIER -59.13 -31.46 68.97 Favored 'General case' 0 C--O 1.173 -2.951 0 N-CA-C 108.397 -0.964 . . . . 51.840000000000003 108.397 178.222 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.422 ' H ' ' HB3' ' A' ' -1' ' ' HIS 0.29 13.8 m-20 -54.76 14.17 0.0 OUTLIER 'General case' 0 C--O 1.179 -2.608 0 C-N-CA 117.928 -1.509 . . . . 48.710000000000001 113.899 171.21 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 1' ' ' CYS . . . -89.71 -14.51 34.54 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 127.455 2.302 . . . . 36.350000000000001 114.088 159.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -99.36 -21.38 16.04 Favored 'General case' 0 C--O 1.168 -3.2 0 CA-C-N 114.481 -1.236 . . . . 20.460000000000001 109.401 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.9 134.85 27.92 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.296 0 C-N-CA 120.216 -0.594 . . . . 19.100000000000001 112.471 -171.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.12 -150.99 22.23 Favored Glycine 0 C--O 1.171 -3.785 0 N-CA-C 115.59 0.996 . . . . 19.780000000000001 115.59 171.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 m -126.63 126.48 43.66 Favored 'General case' 0 C--O 1.184 -2.387 0 N-CA-C 111.842 0.312 . . . . 27.739999999999998 111.842 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -122.85 140.41 52.98 Favored 'General case' 0 C--O 1.186 -2.268 0 O-C-N 125.484 1.74 . . . . 19.079999999999998 111.842 -167.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.0 pttt -123.12 136.47 54.8 Favored 'General case' 0 C--O 1.156 -3.852 0 CA-C-O 122.313 1.054 . . . . 36.090000000000003 110.714 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 tp -68.55 129.1 38.93 Favored 'General case' 0 C--O 1.176 -2.785 0 O-C-N 121.224 -0.922 . . . . 18.289999999999999 110.723 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 15.1 m -117.74 -19.34 6.09 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 N-CA-C 116.093 1.886 . . . . 21.68 116.093 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.0 p -152.33 153.6 33.99 Favored 'General case' 0 C--O 1.168 -3.233 0 N-CA-C 115.771 1.767 . . . . 26.809999999999999 115.771 168.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.1 t -138.04 134.66 35.04 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 124.33 1.019 . . . . 22.030000000000001 109.345 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -130.91 136.16 48.34 Favored 'General case' 0 C--O 1.194 -1.826 0 N-CA-C 108.869 -0.789 . . . . 29.41 108.869 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.7 m120 61.58 20.55 11.36 Favored 'General case' 0 C--O 1.172 -3.002 0 N-CA-C 115.153 1.538 . . . . 21.469999999999999 115.153 171.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -65.34 -38.01 88.82 Favored 'General case' 0 C--O 1.185 -2.34 0 N-CA-C 113.445 0.905 . . . . 18.510000000000002 113.445 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.51 -39.72 94.31 Favored 'General case' 0 C--O 1.183 -2.42 0 C-N-CA 119.406 -0.918 . . . . 26.920000000000002 109.351 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.61 -39.04 81.02 Favored 'General case' 0 C--O 1.189 -2.101 0 N-CA-C 109.158 -0.682 . . . . 39.57 109.158 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -60.66 -49.32 77.98 Favored 'General case' 0 C--O 1.179 -2.638 0 N-CA-C 106.633 -1.617 . . . . 16.879999999999999 106.633 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.7 mtm -59.03 -43.75 91.66 Favored 'General case' 0 C--O 1.158 -3.73 0 N-CA-C 113.677 0.991 . . . . 14.85 113.677 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -57.94 -40.56 80.79 Favored 'General case' 0 C--O 1.165 -3.349 0 C-N-CA 118.962 -1.095 . . . . 27.920000000000002 109.952 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.26 -32.69 73.04 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-O 121.646 0.736 . . . . 39.049999999999997 111.938 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.49 -31.7 53.89 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.67 0 CA-C-N 115.17 -0.923 . . . . 20.609999999999999 112.536 172.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.17 11.5 15.75 Favored Glycine 0 C--O 1.185 -2.921 0 N-CA-C 115.52 0.968 . . . . 21.530000000000001 115.52 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.71 133.3 32.03 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.491 0 C-N-CA 120.434 -0.507 . . . . 17.199999999999999 110.445 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.95 155.46 38.41 Favored Glycine 0 C--O 1.176 -3.471 0 O-C-N 124.703 1.252 . . . . 19.850000000000001 114.572 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -50.65 -56.45 11.79 Favored 'General case' 0 C--O 1.155 -3.873 0 N-CA-C 113.87 1.063 . . . . 19.5 113.87 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.49 -45.44 94.24 Favored 'General case' 0 C--O 1.172 -3.007 0 CA-C-O 121.847 0.832 . . . . 16.399999999999999 110.91 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.2 m -61.65 -39.91 93.04 Favored 'General case' 0 C--O 1.157 -3.809 0 CA-C-N 115.852 -0.613 . . . . 18.039999999999999 112.446 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -60.65 -41.08 94.26 Favored 'General case' 0 C--O 1.183 -2.402 0 CA-C-N 118.657 0.662 . . . . 17.309999999999999 111.518 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -65.95 -47.09 75.8 Favored 'General case' 0 C--O 1.194 -1.845 0 CA-C-N 115.699 -0.682 . . . . 27.420000000000002 110.618 -177.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 77.3 t -73.69 -38.33 51.15 Favored 'Isoleucine or valine' 0 C--O 1.177 -2.739 0 CA-C-N 115.385 -0.825 . . . . 17.809999999999999 112.439 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.19 94.39 Favored 'General case' 0 C--O 1.156 -3.818 0 N-CA-C 115.87 1.804 . . . . 16.239999999999998 115.87 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 -17.18 74.65 Favored Glycine 1 C--O 1.159 -4.587 0 CA-C-O 121.746 0.637 . . . . 16.300000000000001 114.058 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 86.7 mmm -80.0 -26.87 39.71 Favored 'General case' 0 C--O 1.157 -3.8 0 O-C-N 121.826 -0.808 . . . . 19.420000000000002 113.162 177.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.03 144.42 57.11 Favored 'General case' 0 C--O 1.171 -3.075 0 N-CA-C 114.264 1.209 . . . . 16.359999999999999 114.264 -174.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -121.81 71.75 30.53 Favored Pre-proline 0 C--O 1.173 -2.923 0 CA-C-O 122.655 1.217 . . . . 46.479999999999997 107.915 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.445 ' HB3' ' HB2' ' A' ' 55' ' ' SER . 36.5 Cg_endo -63.08 151.62 83.81 Favored 'Trans proline' 0 C--O 1.16 -3.425 0 N-CA-C 113.92 0.7 . . . . 16.43 113.92 -175.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -89.19 151.54 22.11 Favored 'General case' 0 C--O 1.172 -2.987 0 O-C-N 126.08 2.113 . . . . 27.43 110.635 153.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.4 ttp -128.71 128.64 44.46 Favored 'General case' 0 C--O 1.196 -1.734 0 N-CA-C 107.962 -1.125 . . . . 17.289999999999999 107.962 176.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.25 126.41 72.81 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.354 0 N-CA-C 106.968 -1.493 . . . . 24.859999999999999 106.968 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -123.74 129.15 74.6 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.241 0 O-C-N 123.547 0.53 . . . . 16.52 109.893 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 p -142.46 158.42 43.7 Favored 'General case' 0 C--O 1.18 -2.579 0 N-CA-C 109.368 -0.604 . . . . 24.510000000000002 109.368 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.4 t -129.28 139.54 51.52 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.171 0 O-C-N 124.757 1.286 . . . . 19.98 108.358 -177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.609 ' C ' HD22 ' A' ' 45' ' ' ASN . 0.1 OUTLIER -144.4 103.16 3.93 Favored 'General case' 0 C--O 1.174 -2.918 0 N-CA-C 105.341 -2.096 . . . . 18.670000000000002 105.341 178.721 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 57.31 -120.59 21.82 Favored Glycine 0 C--O 1.185 -2.937 0 CA-C-N 115.623 -0.717 . . . . 23.390000000000001 111.624 -168.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -90.93 -2.29 57.74 Favored 'General case' 0 C--O 1.175 -2.848 0 N-CA-C 113.309 0.855 . . . . 35.710000000000001 113.309 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -99.54 123.45 52.29 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.164 0 CA-C-O 119.295 -0.383 . . . . 17.870000000000001 111.511 -172.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 67.3 mt -102.18 135.31 39.76 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.3 0 N-CA-C 106.68 -1.6 . . . . 16.710000000000001 106.68 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.7 m -118.76 132.14 56.14 Favored 'General case' 0 C--O 1.176 -2.767 0 CA-C-O 120.965 0.412 . . . . 15.48 110.114 173.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 53.7 mt -124.37 127.79 73.34 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.916 0 O-C-N 125.104 1.503 . . . . 15.66 108.82 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HE2' ' OE2' ' A' ' 61' ' ' GLU . 13.2 mttt -123.53 148.99 45.76 Favored 'General case' 0 C--O 1.186 -2.255 0 O-C-N 124.872 1.357 . . . . 50.710000000000001 111.655 176.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 94.0 p -111.76 145.68 38.92 Favored 'General case' 0 C--O 1.171 -3.034 0 O-C-N 125.678 1.861 . . . . 19.34 108.227 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -126.18 109.43 12.33 Favored 'General case' 0 C--O 1.193 -1.882 0 N-CA-C 102.907 -2.997 . . . . 60.350000000000001 102.907 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 38' ' ' PRO . 3.7 t -150.54 147.34 27.35 Favored 'General case' 0 C--O 1.174 -2.896 0 C-N-CA 119.489 -0.884 . . . . 20.68 111.676 -167.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.5 p -68.78 -13.58 62.49 Favored 'General case' 0 C--O 1.185 -2.305 0 N-CA-C 113.251 0.834 . . . . 26.0 113.251 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -89.18 -49.27 6.84 Favored 'General case' 0 C--O 1.173 -2.96 0 C-N-CA 120.34 -0.544 . . . . 23.68 111.776 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -167.59 125.08 1.19 Allowed 'General case' 0 C--O 1.196 -1.712 0 CA-C-O 121.527 0.68 . . . . 41.560000000000002 111.668 -175.054 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -92.07 115.7 28.29 Favored 'General case' 0 C--O 1.178 -2.697 0 CA-C-N 114.254 -1.339 . . . . 26.539999999999999 108.983 172.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.4 p -133.69 169.48 16.96 Favored 'General case' 0 C--O 1.183 -2.401 0 C-N-CA 124.47 1.108 . . . . 23.379999999999999 112.561 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.711 ' OE2' ' HE2' ' A' ' 52' ' ' LYS . 6.5 tt0 -151.58 144.62 24.56 Favored 'General case' 0 C--O 1.183 -2.415 0 C-N-CA 119.842 -0.743 . . . . 36.469999999999999 109.665 174.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.5 pt -126.8 138.59 54.33 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.209 0 O-C-N 124.781 1.3 . . . . 13.93 110.326 170.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 60.1 m -124.16 137.94 54.48 Favored 'General case' 0 C--O 1.172 -3.02 0 CA-C-N 114.051 -1.431 . . . . 16.260000000000002 110.339 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -160.15 160.48 32.96 Favored 'General case' 0 C--O 1.162 -3.545 0 N-CA-C 114.44 1.274 . . . . 14.300000000000001 114.44 -170.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.5 mt -110.42 134.95 50.99 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.957 0 N-CA-C 107.89 -1.152 . . . . 15.52 107.89 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.7 mt -57.1 132.39 52.77 Favored 'General case' 0 C--O 1.171 -3.048 0 N-CA-C 108.268 -1.012 . . . . 19.870000000000001 108.268 -174.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.6 -3.41 86.69 Favored Glycine 0 C--O 1.177 -3.409 0 O-C-N 125.046 1.466 . . . . 15.449999999999999 115.951 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -110.11 119.28 38.78 Favored 'General case' 0 C--O 1.176 -2.792 0 CA-C-N 117.164 0.482 . . . . 24.48 111.637 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.74 141.02 58.48 Favored 'General case' 0 C--O 1.195 -1.79 0 O-C-N 123.197 0.31 . . . . 36.539999999999999 110.604 -173.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -135.56 164.69 27.25 Favored 'General case' 0 C--O 1.179 -2.644 0 O-C-N 125.719 1.887 . . . . 14.23 115.217 173.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -89.87 139.58 30.45 Favored 'General case' 0 C--O 1.16 -3.611 0 N-CA-C 108.47 -0.937 . . . . 25.539999999999999 108.47 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -139.2 135.4 33.92 Favored 'General case' 0 C--O 1.164 -3.427 0 N-CA-C 109.143 -0.688 . . . . 22.539999999999999 109.143 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.47 113.5 41.62 Favored 'Isoleucine or valine' 1 C--O 1.145 -4.409 0 N-CA-C 104.818 -2.289 . . . . 24.52 104.818 170.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 53.1 p -73.74 166.47 23.25 Favored 'General case' 1 C--O 1.151 -4.094 0 CA-C-O 121.105 0.479 . . . . 19.59 112.023 -176.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -56.14 -35.74 67.47 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 113.463 0.912 . . . . 22.82 113.463 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -84.98 12.49 7.46 Favored 'General case' 0 C--O 1.177 -2.731 0 N-CA-C 114.53 1.307 . . . . 23.09 114.53 174.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.272 63.6 m-20 68.09 27.09 7.03 Favored 'General case' 0 C--O 1.187 -2.222 0 N-CA-C 115.768 1.766 . . . . 35.079999999999998 115.768 173.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -76.81 138.44 39.85 Favored 'General case' 0 C--O 1.194 -1.86 0 O-C-N 121.925 -0.485 . . . . 21.100000000000001 110.085 161.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.491 ' HD2' ' N ' ' A' ' 79' ' ' LYS . 2.7 mptp? -97.44 113.28 24.93 Favored 'General case' 0 C--O 1.154 -3.927 0 N-CA-C 106.51 -1.663 . . . . 24.399999999999999 106.51 169.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 9.5 m -126.07 164.3 26.13 Favored 'Isoleucine or valine' 0 C--O 1.169 -3.133 0 N-CA-C 111.851 0.315 . . . . 18.010000000000002 111.851 -174.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -105.39 126.71 52.42 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.093 -1.077 . . . . 35.829999999999998 108.093 168.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -120.12 149.37 42.32 Favored 'General case' 0 C--O 1.158 -3.732 0 O-C-N 124.927 1.392 . . . . 16.039999999999999 113.782 -173.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -139.04 132.39 30.07 Favored 'General case' 0 C--O 1.184 -2.365 0 N-CA-C 108.574 -0.899 . . . . 17.460000000000001 108.574 171.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 68.5 mt -117.72 126.94 75.09 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.06 0 CA-C-N 114.586 -1.188 . . . . 14.779999999999999 109.723 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.3 p -126.05 165.3 19.08 Favored 'General case' 0 C--O 1.169 -3.15 0 C-N-CA 124.731 1.212 . . . . 17.859999999999999 110.896 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.11 111.87 23.09 Favored 'General case' 0 C--O 1.194 -1.854 0 N-CA-C 106.525 -1.657 . . . . 27.890000000000001 106.525 176.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -109.12 93.31 4.45 Favored 'General case' 0 N--CA 1.423 -1.815 0 N-CA-C 105.918 -1.882 . . . . 55.670000000000002 105.918 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 42.56 69.04 0.65 Allowed Glycine 0 C--O 1.209 -1.434 0 CA-C-N 114.558 -1.201 . . . . 35.189999999999998 115.66 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.3 -19.38 27.58 Favored Glycine 0 C--N 1.287 -2.189 0 C-N-CA 115.002 -3.475 . . . . 25.309999999999999 118.761 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.45 131.52 54.6 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.398 0 N-CA-C 109.492 -0.558 . . . . 21.48 109.492 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.9 mt -88.12 122.84 32.16 Favored 'General case' 0 C--O 1.179 -2.619 0 N-CA-C 107.559 -1.274 . . . . 22.09 107.559 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.4 t -113.22 118.72 58.84 Favored 'Isoleucine or valine' 0 C--O 1.154 -3.957 0 O-C-N 124.729 1.268 . . . . 18.190000000000001 108.923 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -117.2 110.25 17.91 Favored 'General case' 0 C--O 1.189 -2.13 0 O-C-N 124.546 1.154 . . . . 14.67 108.521 -173.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 43.2 t -108.58 125.8 65.44 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.69 0 CA-C-O 119.019 -0.515 . . . . 17.420000000000002 110.44 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -112.59 131.87 55.41 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 124.818 1.324 . . . . 16.699999999999999 111.212 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -125.98 134.66 51.43 Favored 'General case' 0 C--O 1.162 -3.536 0 O-C-N 124.362 1.039 . . . . 40.259999999999998 110.549 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 4.1 p90 -162.21 144.64 11.26 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 125.103 1.502 . . . . 22.449999999999999 110.724 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 42.65 42.11 2.71 Favored 'General case' 0 C--O 1.173 -2.921 0 CA-C-N 113.188 -1.824 . . . . 30.550000000000001 111.488 175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.84 12.87 65.45 Favored Glycine 0 C--O 1.198 -2.118 0 N-CA-C 117.868 1.907 . . . . 32.200000000000003 117.868 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.605 ' HE3' ' O ' ' A' ' 359' ' ' HOH . 24.6 mttt -109.14 168.32 9.46 Favored 'General case' 0 C--O 1.183 -2.442 0 C-N-CA 123.607 0.763 . . . . 48.630000000000003 109.055 174.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -155.3 155.28 33.46 Favored 'General case' 0 C--O 1.169 -3.166 0 CA-C-N 114.652 -1.158 . . . . 27.98 111.272 171.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.7 t -143.79 151.31 39.79 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 106.586 -1.635 . . . . 16.120000000000001 106.586 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.0 m -128.88 131.62 47.65 Favored 'General case' 0 C--O 1.183 -2.421 0 CA-C-N 114.839 -1.073 . . . . 17.48 109.365 -175.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 63.5 mt -118.67 120.77 65.18 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.915 0 N-CA-C 106.922 -1.511 . . . . 21.809999999999999 106.922 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -112.22 137.87 49.72 Favored 'General case' 0 C--O 1.173 -2.945 0 N-CA-C 107.261 -1.385 . . . . 32.579999999999998 107.261 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.6 mtt85 -130.27 127.34 39.34 Favored 'General case' 0 C--O 1.164 -3.421 0 N-CA-C 109.307 -0.627 . . . . 18.02 109.307 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 107' ' ' LYS . 14.8 ptmt -150.2 153.67 36.65 Favored 'General case' 0 C--O 1.184 -2.378 0 C-N-CA 119.299 -0.961 . . . . 22.52 111.96 -178.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -84.85 127.41 34.13 Favored 'General case' 0 C--O 1.182 -2.499 0 O-C-N 124.802 1.314 . . . . 23.43 111.165 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -135.92 121.14 19.03 Favored 'General case' 0 C--O 1.161 -3.589 0 C-N-CA 119.169 -1.012 . . . . 47.939999999999998 110.355 169.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.56 -135.83 1.44 Allowed 'General case' 0 C--O 1.191 -1.991 0 N-CA-C 106.738 -1.579 . . . . 27.280000000000001 106.738 -171.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -89.83 16.58 7.85 Favored 'General case' 0 C--O 1.193 -1.89 0 N-CA-C 114.597 1.332 . . . . 21.66 114.597 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.27 154.13 23.87 Favored 'General case' 0 C--O 1.164 -3.436 0 CA-C-N 115.221 -0.9 . . . . 20.579999999999998 111.789 -178.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.8 tt -112.45 115.01 28.0 Favored 'General case' 0 C--O 1.183 -2.418 0 N-CA-C 105.85 -1.907 . . . . 21.539999999999999 105.85 167.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.6 t -100.7 127.7 53.55 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.788 0 CA-C-N 113.833 -1.531 . . . . 16.920000000000002 109.743 -173.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.8 t -115.78 120.25 64.22 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.289 0 CA-C-O 118.304 -0.855 . . . . 15.529999999999999 109.783 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.445 ' HG3' ' CG2' ' A' ' 123' ' ' THR . 60.1 tt0 -112.59 119.85 39.55 Favored 'General case' 0 C--O 1.183 -2.439 0 N-CA-C 105.635 -1.987 . . . . 25.469999999999999 105.635 -177.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 34.0 m -104.71 125.75 51.11 Favored 'General case' 0 C--O 1.196 -1.724 0 O-C-N 124.046 0.841 . . . . 19.550000000000001 109.542 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.4 t -125.0 129.7 73.34 Favored 'Isoleucine or valine' 0 C--O 1.167 -3.246 0 CA-C-N 115.074 -0.966 . . . . 19.620000000000001 113.602 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 16.0 tpt -137.38 105.45 5.68 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 107.285 -1.376 . . . . 21.34 107.285 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? 61.69 -113.4 0.51 Allowed 'General case' 0 C--O 1.19 -2.058 0 N-CA-C 105.578 -2.008 . . . . 22.399999999999999 105.578 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.79 5.04 56.47 Favored Glycine 0 C--O 1.178 -3.357 0 C-N-CA 118.82 -1.657 . . . . 14.720000000000001 115.805 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 56.0 t -103.96 129.13 56.62 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.855 0 C-N-CA 119.044 -1.062 . . . . 23.48 111.186 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . 0.445 ' CG2' ' HG3' ' A' ' 116' ' ' GLU . 55.6 m -116.24 135.2 54.11 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 114.021 1.119 . . . . 23.079999999999998 114.021 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 42.2 t -114.86 133.14 56.21 Favored 'General case' 0 C--O 1.188 -2.162 0 CA-C-N 115.567 -0.742 . . . . 16.43 112.548 170.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 25.5 m -108.93 121.85 45.97 Favored 'General case' 0 C--O 1.164 -3.416 0 CA-C-O 121.002 0.429 . . . . 18.739999999999998 111.514 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.4 mtp85 -120.67 119.67 33.49 Favored 'General case' 0 N--CA 1.416 -2.161 0 CA-C-N 115.075 -0.966 . . . . 26.77 110.875 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.2 t -107.68 126.65 64.05 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.888 0 O-C-N 124.443 1.089 . . . . 16.030000000000001 111.508 -171.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -113.71 146.39 39.92 Favored 'General case' 0 C--O 1.182 -2.493 0 O-C-N 123.925 0.765 . . . . 15.69 112.314 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -121.2 164.26 17.2 Favored 'General case' 0 C--O 1.159 -3.664 0 C-N-CA 124.646 1.178 . . . . 24.219999999999999 109.339 170.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 130' ' ' ARG . 14.6 mtt-85 -64.46 140.71 58.9 Favored 'General case' 0 C--O 1.183 -2.413 0 CA-C-O 121.595 0.712 . . . . 24.920000000000002 111.778 -179.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.595 0 CA-C-O 118.377 -0.82 . . . . 36.920000000000002 111.559 -178.106 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' L96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' HOH . . . . . 0.605 ' O ' ' HE3' ' A' ' 100' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_