data_1r22_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 1r22 _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 ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 123.259 1.504 . . . . 66.89 113.689 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -108.43 135.32 49.91 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 113.158 -1.837 . . . . 69.51 111.663 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.05 154.91 37.74 Favored 'General case' 0 CA--C 1.486 -1.484 0 CA-C-N 114.399 -1.273 . . . . 50.31 107.914 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 pt -58.08 149.66 4.88 Favored 'Isoleucine or valine' 0 C--O 1.258 1.524 0 C-N-CA 119.106 -1.038 . . . . 42.8 111.383 169.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.65 140.2 38.46 Favored Pre-proline 0 C--O 1.212 -0.877 0 CA-C-N 114.451 -1.25 . . . . 41.12 111.754 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -45.44 -42.7 17.91 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-O 116.568 -1.513 . . . . 42.08 115.082 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -39.52 93.67 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.455 1.48 . . . . 57.51 112.401 -179.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.8 t -63.11 -42.96 98.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 114.353 -1.294 . . . . 34.69 110.658 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.06 99.17 Favored 'General case' 0 C--O 1.259 1.57 0 N-CA-C 112.981 0.734 . . . . 32.05 112.981 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -69.94 -35.82 74.83 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 107.687 -1.227 . . . . 45.05 107.687 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.2 m -72.37 -39.37 68.12 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 119.197 0.908 . . . . 33.97 109.733 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.4 tp -64.48 -37.87 89.06 Favored 'General case' 0 C--O 1.261 1.665 0 CA-C-O 121.828 0.823 . . . . 31.57 108.941 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.07 -47.17 81.65 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.597 1.189 . . . . 25.15 113.631 171.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.61 -30.01 71.03 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.527 -1.269 . . . . 43.48 114.358 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -76.2 -43.84 40.58 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 125.054 1.471 . . . . 32.12 112.566 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.87 -42.09 92.96 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 115.717 1.747 . . . . 27.98 115.717 168.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.98 -48.19 21.71 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.703 1.371 . . . . 24.53 114.703 170.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.32 -34.64 58.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.956 -0.698 . . . . 34.89 112.753 174.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.05 -16.47 63.71 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 115.671 1.73 . . . . 29.76 115.671 173.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.37 48.22 1.37 Allowed 'General case' 0 C--O 1.205 -1.252 0 CA-C-O 122.154 0.978 . . . . 31.83 111.929 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -144.93 117.76 5.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 107.62 -1.252 . . . . 42.44 107.62 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.46 -32.66 88.79 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 CA-C-O 117.572 -1.095 . . . . 29.51 114.926 -175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -69.99 -47.32 62.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.987 0.812 . . . . 36.66 109.582 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . 0.51 ' NH1' ' O ' ' A' 1005 ' ' HOH . 77.3 mtt180 -52.65 -44.94 66.48 Favored 'General case' 0 C--O 1.283 2.826 0 CA-C-O 122.402 1.096 . . . . 57.95 113.871 171.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.5 -30.69 71.77 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 114.693 -1.139 . . . . 25.67 111.72 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . 0.479 ' O ' ' OG ' ' A' ' 53' ' ' SER . 11.0 mtp180 -65.71 -46.68 78.08 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 123.34 0.656 . . . . 43.67 110.535 177.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.8 mt -57.62 -49.58 75.98 Favored 'General case' 0 CA--C 1.478 -1.82 0 O-C-N 123.425 0.453 . . . . 37.11 111.402 175.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.01 -31.13 71.48 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 113.71 1.004 . . . . 38.53 113.71 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . 0.479 ' OG ' ' O ' ' A' ' 50' ' ' ARG . 34.2 p -62.09 -31.72 72.2 Favored 'General case' 0 C--O 1.178 -2.665 0 C-N-CA 119.507 -0.877 . . . . 32.01 109.842 175.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.8 mt -75.49 -56.99 4.16 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.633 -0.877 . . . . 38.38 108.633 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.48 -23.42 10.2 Favored 'General case' 0 C--O 1.195 -1.807 0 N-CA-C 113.38 0.881 . . . . 36.96 113.38 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.98 -27.63 69.26 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.828 1.418 . . . . 45.45 114.828 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -94.15 -25.45 17.12 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 119.029 -0.51 . . . . 72.91 110.587 -177.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -171.71 163.34 6.48 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 118.987 0.812 . . . . 51.5 112.41 175.796 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 58' ' ' SER . 5.9 pt-20 -69.52 153.3 43.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.646 -0.872 . . . . 63.36 108.646 165.308 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 22.4 mt -155.92 150.93 26.42 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.258 -1.015 . . . . 53.67 108.258 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . . . -73.6 160.0 32.27 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 113.016 0.747 . . . . 52.0 113.016 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 t -42.78 -41.47 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 116.79 2.144 . . . . 56.02 116.79 167.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -86.5 -23.73 42.2 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 117.539 1.775 . . . . 54.13 117.539 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -68.07 -31.09 70.48 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 119.556 -2.143 . . . . 56.95 110.186 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.2 mt -75.88 -46.09 32.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.401 1.08 . . . . 58.72 109.62 -174.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.03 -40.08 72.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.758 -1.11 . . . . 61.28 111.086 172.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -73.52 -25.51 60.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.644 -0.66 . . . . 66.21 112.476 -178.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.75 -43.14 31.79 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.417 0.895 . . . . 61.75 113.417 172.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.6 mm -80.72 -6.57 9.78 Favored 'Isoleucine or valine' 0 C--O 1.255 1.394 0 N-CA-C 108.471 -0.937 . . . . 62.84 108.471 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.59 61.7 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-O 118.291 -1.283 . . . . 66.01 114.676 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.3 m -128.51 -161.7 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 117.988 0.894 . . . . 68.19 110.312 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 53.4 p -93.09 177.78 5.95 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 115.25 1.574 . . . . 72.4 115.25 -170.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.83 -59.53 2.56 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.313 -0.858 . . . . 78.28 109.203 178.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -5.92 0.95 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.77 1.026 . . . . 75.87 113.77 179.448 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.63 9.25 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.976 1.473 . . . . 75.16 114.976 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.0 -40.45 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 105.427 -2.064 . . . . 72.32 105.427 170.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.8 m -74.42 4.18 6.33 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 114.434 -1.257 . . . . 75.47 112.248 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -96.9 -37.98 10.0 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 121.688 -0.632 . . . . 75.88 110.171 167.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -80.58 -35.32 34.4 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.702 -0.681 . . . . 73.94 110.444 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.1 -55.57 9.11 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.392 -0.966 . . . . 70.95 108.392 -177.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -51.99 -12.93 0.25 Allowed 'General case' 0 CA--C 1.55 0.979 0 O-C-N 124.803 1.314 . . . . 80.4 114.021 168.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . 0.47 ' OG ' ' NH2' ' A' ' 48' ' ' ARG . 23.1 t -83.18 -51.54 7.4 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.556 -0.858 . . . . 66.77 109.365 164.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mt -67.54 -15.37 63.62 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 113.332 0.864 . . . . 66.84 113.332 -172.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 85' ' ' ASN . 35.6 ptt180 -72.05 -58.1 3.72 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 104.246 -2.502 . . . . 78.79 104.246 -178.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . 0.428 ' N ' ' CG ' ' A' ' 84' ' ' ARG . 7.1 p30 -61.75 -14.16 29.81 Favored 'General case' 0 C--O 1.262 1.742 0 N-CA-C 113.215 0.82 . . . . 70.28 113.215 -178.011 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.5 mt -88.39 -20.1 25.72 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.943 -1.026 . . . . 58.13 113.38 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . 0.536 ' NH2' ' OE2' ' B' ' 120' ' ' GLU . 25.5 mtp-105 90.47 26.54 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.202 0 CA-C-O 122.725 1.25 . . . . 56.58 112.588 170.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -98.57 -38.6 9.08 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 113.68 -1.6 . . . . 44.43 109.578 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.67 154.08 31.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.042 0 N-CA-C 116.788 2.144 . . . . 40.97 116.788 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 69.5 p -124.52 163.55 21.65 Favored 'General case' 0 C--O 1.204 -1.315 0 CA-C-N 116.085 -0.507 . . . . 47.21 110.026 173.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -143.28 149.75 38.29 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 117.23 2.308 . . . . 71.5 117.23 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 124.072 1.892 . . . . 60.03 107.505 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . 0.63 ' CD2' ' N ' ' A' ' 97' ' ' HIS 0.281 0.0 OUTLIER . . . . . 1 N--CA 1.54 4.043 0 CA-C-O 124.614 2.149 . . . . 76.71 113.002 . . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.22 153.77 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 1 CA-C-N 107.957 -4.201 . . . . 64.12 107.44 -176.504 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -119.5 135.39 54.79 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.135 -0.691 . . . . 68.99 109.135 169.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -111.46 145.02 39.74 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-O 122.664 1.221 . . . . 48.11 113.8 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -136.7 165.29 26.25 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-N 111.741 -2.481 . . . . 46.63 111.262 170.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 34.1 mt -61.73 131.68 50.7 Favored 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 106.804 -1.554 . . . . 37.07 106.804 163.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -46.21 -46.56 17.65 Favored 'General case' 0 C--O 1.21 -0.983 0 C-N-CA 125.29 1.436 . . . . 57.15 112.565 -171.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -170.52 179.58 3.28 Favored 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 123.719 0.808 . . . . 41.11 110.838 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 15.5 p-80 -51.59 -28.98 15.73 Favored 'General case' 0 CA--C 1.59 2.509 0 O-C-N 125.906 2.004 . . . . 46.27 113.99 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -67.72 -47.38 69.51 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.117 1.781 . . . . 33.6 111.239 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.5 mm -55.92 -44.72 78.92 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 113.867 -1.515 . . . . 30.5 114.701 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.4 t -60.63 -46.74 95.24 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 N-CA-C 108.536 -0.913 . . . . 36.24 108.536 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.41 -42.85 87.2 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.726 1.21 . . . . 34.03 108.182 -169.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.5 tp -64.0 -54.74 29.61 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.467 2.307 . . . . 38.96 110.345 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -56.04 -44.58 78.95 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 116.089 1.885 . . . . 33.53 116.089 173.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -69.77 -42.55 73.69 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 123.285 1.516 . . . . 37.43 114.346 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -63.84 -43.1 97.17 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.946 -1.024 . . . . 29.65 111.445 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.59 -49.71 76.72 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.438 -0.801 . . . . 22.13 111.462 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.2 tp -72.28 -41.16 66.98 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 114.729 -1.123 . . . . 26.95 111.693 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.9 -43.88 94.57 Favored 'General case' 0 N--CA 1.513 2.722 0 C-N-CA 118.885 -1.126 . . . . 44.42 113.833 169.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HIS . . . . . 0.444 ' CD2' ' CD1' ' B' ' 107' ' ' ILE . 74.6 t60 -61.84 -42.8 99.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.708 -1.197 . . . . 29.94 110.502 -179.842 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.6 tp -63.8 -27.38 69.14 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.645 1.212 . . . . 35.7 111.189 179.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -28.39 60.84 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-N 115.021 -0.99 . . . . 49.42 112.847 -177.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.22 -36.41 41.55 Favored 'General case' 0 C--O 1.197 -1.658 0 C-N-CA 123.831 0.852 . . . . 45.62 109.573 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.276 2.462 0 CA-C-O 123.945 1.831 . . . . 58.39 113.258 170.771 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 . . . . . 0 N--CA 1.534 3.762 0 CA-C-O 122.23 1.014 . . . . 62.89 113.073 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 80.19 116.39 0.06 Allowed 'General case' 0 C--O 1.275 2.433 0 CA-C-O 123.73 1.729 . . . . 45.94 110.718 -165.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 43.2 pt -54.41 152.94 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 111.819 -2.446 . . . . 35.29 112.927 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.85 150.38 97.82 Favored Pre-proline 0 CA--C 1.469 -2.142 0 N-CA-C 106.544 -1.65 . . . . 29.45 106.544 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -48.98 -42.74 37.66 Favored 'Trans proline' 0 CA--C 1.569 2.269 0 C-N-CA 121.855 1.703 . . . . 29.51 113.564 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -44.79 85.64 Favored 'General case' 0 C--O 1.195 -1.769 0 C-N-CA 125.758 1.623 . . . . 41.92 108.731 -177.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.35 -40.08 87.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.882 0 N-CA-C 108.323 -0.992 . . . . 30.56 108.323 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.68 -38.7 90.01 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.042 1.877 . . . . 21.95 113.47 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLN . . . . . 0.764 ' NE2' ' O ' ' B' 1040 ' ' HOH . 7.2 tp-100 -62.78 -46.76 86.49 Favored 'General case' 0 N--CA 1.396 -3.131 0 CA-C-N 113.897 -1.501 . . . . 27.63 112.41 173.13 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 31.7 m -60.4 -44.41 95.71 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 113.958 1.095 . . . . 23.86 113.958 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.5 tp -62.5 -38.63 90.64 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 116.974 -1.488 . . . . 18.92 111.356 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.98 -39.99 96.39 Favored 'General case' 1 C--O 1.146 -4.376 0 CA-C-N 121.231 1.832 . . . . 11.97 110.322 178.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.52 -38.75 92.33 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 126.936 2.094 . . . . 35.45 112.663 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -58.69 -46.88 86.27 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-N 119.737 1.153 . . . . 15.94 112.385 168.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -70.1 -33.63 72.11 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 115.107 1.521 . . . . 24.01 115.107 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.03 -44.75 71.27 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-O 123.19 1.471 . . . . 18.51 114.031 171.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 64.5 t -53.01 -40.31 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 120.099 -1.625 . . . . 25.11 113.024 168.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.64 -16.35 58.6 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 123.977 1.846 . . . . 17.71 112.661 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.8 44.71 0.93 Allowed 'General case' 0 C--O 1.291 3.254 0 N-CA-C 116.129 1.9 . . . . 29.31 116.129 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -134.43 133.61 21.74 Favored Pre-proline 0 C--O 1.193 -1.894 0 CA-C-O 118.079 -0.962 . . . . 43.76 110.672 169.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.97 -46.81 17.59 Favored 'Trans proline' 0 C--O 1.206 -1.095 0 C-N-CA 121.726 1.617 . . . . 23.75 113.382 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -61.23 -43.02 99.56 Favored 'General case' 0 C--O 1.185 -2.296 0 N-CA-C 113.731 1.011 . . . . 39.54 113.731 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 -63.92 -37.45 87.44 Favored 'General case' 0 CA--C 1.563 1.454 0 CA-C-N 120.001 1.273 . . . . 42.6 111.129 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 24.3 mt -67.19 -33.5 75.53 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.045 0.938 . . . . 23.15 110.982 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -65.03 -43.02 93.79 Favored 'General case' 0 N--CA 1.423 -1.8 0 O-C-N 123.692 0.62 . . . . 42.58 110.638 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.04 -52.39 65.47 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 114.177 1.177 . . . . 30.75 114.177 171.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.0 mt -53.77 -36.52 62.48 Favored 'General case' 0 CA--C 1.559 1.305 0 N-CA-C 117.769 2.507 . . . . 24.96 117.769 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 21.6 p -62.72 -35.28 79.24 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-O 121.296 0.569 . . . . 27.87 110.457 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 49.4 mt -75.35 -47.59 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 120.279 -0.568 . . . . 22.63 110.299 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.72 -17.5 64.18 Favored 'General case' 0 C--O 1.19 -2.056 0 O-C-N 121.907 -0.496 . . . . 22.94 112.241 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.99 -29.55 69.95 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.844 1.257 . . . . 34.15 109.345 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ARG . . . . . 0.55 ' O ' ' CB ' ' B' ' 58' ' ' SER . 17.8 mtp-105 -119.64 91.66 3.6 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 125.432 1.493 . . . . 73.55 107.567 172.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 57' ' ' ARG . 22.8 t 93.91 135.74 0.02 OUTLIER 'General case' 0 C--O 1.26 1.612 0 N-CA-C 116.883 2.179 . . . . 42.78 116.883 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -72.1 130.55 41.16 Favored 'General case' 0 N--CA 1.416 -2.149 0 CA-C-N 110.824 -2.898 . . . . 34.64 103.972 168.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 19.6 mt -134.82 160.14 39.16 Favored 'General case' 0 C--O 1.255 1.344 0 N-CA-C 112.548 0.573 . . . . 28.57 112.548 177.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . . . -83.79 163.8 19.94 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 104.752 -2.314 . . . . 28.19 104.752 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 81.9 t -58.12 -35.32 52.27 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 125.25 1.594 . . . . 25.4 110.714 166.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.09 -46.97 56.57 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 106.432 -2.667 . . . . 27.07 106.432 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -61.23 -45.74 93.28 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.741 0.906 . . . . 38.35 109.742 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 27.7 mt -57.35 -47.43 81.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.745 0.646 . . . . 27.8 112.745 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.68 -42.56 86.35 Favored 'General case' 0 C--O 1.25 1.1 0 N-CA-C 114.926 1.454 . . . . 35.06 114.926 -176.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -52.06 64.76 Favored 'General case' 0 C--O 1.271 2.186 0 N-CA-C 112.305 0.483 . . . . 60.79 112.305 171.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.32 71.27 Favored 'General case' 0 C--O 1.185 -2.3 0 N-CA-C 115.76 1.763 . . . . 37.11 115.76 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ILE . . . . . . . . . . . . . 23.2 mm -93.25 -27.43 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.668 -1.27 . . . . 41.17 111.338 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.95 39.41 7.01 Favored Glycine 0 CA--C 1.533 1.185 0 O-C-N 121.361 -0.837 . . . . 44.0 114.683 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.47 178.88 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.675 0 N-CA-C 105.088 -2.19 . . . . 43.69 105.088 -174.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . 0.903 ' O ' ' CB ' ' B' ' 73' ' ' GLU . 46.7 p -73.28 -26.57 61.14 Favored 'General case' 0 C--O 1.222 -0.361 1 N-CA-C 121.814 4.005 . . . . 44.03 121.814 -165.478 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . 0.903 ' CB ' ' O ' ' B' ' 72' ' ' SER . 5.9 tt0 104.13 -53.59 0.0 OUTLIER 'General case' 0 C--O 1.184 -2.364 0 CA-C-N 123.507 2.867 . . . . 46.03 106.116 -171.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 27.9 t -66.37 -33.94 76.85 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.135 -1.061 . . . . 36.7 108.135 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.66 83.73 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.614 1.196 . . . . 28.85 110.954 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 85.0 t -71.0 -51.41 35.58 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.075 0 CA-C-O 123.127 1.441 . . . . 26.46 111.709 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 7.9 t -53.3 -43.57 67.65 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 126.671 1.989 . . . . 28.25 111.738 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -64.72 -47.59 77.76 Favored 'General case' 0 CA--C 1.606 3.106 0 CA-C-N 115.412 -0.813 . . . . 39.14 110.459 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.12 -35.28 73.18 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.086 1.513 . . . . 37.68 115.086 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -18.42 61.79 Favored 'General case' 0 CA--C 1.576 1.966 0 O-C-N 121.067 -1.021 . . . . 27.04 110.996 -176.911 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 8.9 mtp85 -63.21 -47.03 84.26 Favored 'General case' 0 N--CA 1.424 -1.761 0 O-C-N 120.41 -1.431 . . . . 61.97 111.398 -172.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 64.3 p -81.23 -21.87 39.18 Favored 'General case' 0 N--CA 1.395 -3.184 0 N-CA-C 106.926 -1.509 . . . . 33.01 106.926 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 62.1 mt -67.13 -31.84 72.56 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 120.378 -1.451 . . . . 28.01 112.331 170.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -74.42 -55.04 6.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 121.776 0.798 . . . . 40.91 111.076 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -53.48 -41.39 66.18 Favored 'General case' 0 C--O 1.178 -2.691 0 CA-C-N 114.967 -1.015 . . . . 42.1 111.708 -176.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.65 9.97 27.59 Favored 'General case' 0 C--O 1.199 -1.554 0 O-C-N 119.616 -1.927 . . . . 36.88 110.072 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 59.4 37.14 23.32 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 115.88 1.808 . . . . 41.23 115.88 174.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 1.5 mp -72.84 -30.94 64.42 Favored 'General case' 0 CA--C 1.49 -1.352 0 O-C-N 124.612 1.195 . . . . 29.29 113.534 165.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.48 152.59 33.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 106.965 -1.495 . . . . 26.79 106.965 -177.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 99.3 p -125.19 177.91 5.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.126 -1.064 . . . . 29.46 108.126 167.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -143.84 149.2 36.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.175 0.806 . . . . 37.98 113.175 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -113.66 149.68 34.29 Favored 'General case' 0 CA--C 1.555 1.135 0 O-C-N 124.629 1.206 . . . . 40.71 110.674 166.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . 0.296 7.9 ptpt -95.14 132.9 39.56 Favored 'General case' 0 C--O 1.268 2.049 0 N-CA-C 115.852 1.797 . . . . 50.47 115.852 162.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -127.17 103.35 7.38 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 112.717 -2.038 . . . . 40.4 108.037 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 55.08 -114.49 4.64 Favored Glycine 0 CA--C 1.546 2.003 0 CA-C-O 122.676 1.153 . . . . 34.65 110.245 -173.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -94.09 -4.25 49.68 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 115.814 1.783 . . . . 64.45 115.814 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -89.48 140.36 29.61 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 123.718 1.723 . . . . 47.89 107.219 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 30.6 t -113.22 119.25 60.21 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 113.63 -1.623 . . . . 31.04 111.653 165.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -111.88 128.95 56.29 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.582 -1.266 . . . . 51.44 107.582 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -98.13 150.15 21.76 Favored 'General case' 0 C--O 1.25 1.132 0 CA-C-N 113.462 -1.699 . . . . 26.75 108.265 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -140.94 158.2 44.28 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 113.795 -1.548 . . . . 42.28 111.255 172.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 81.6 mt -51.17 132.12 28.06 Favored 'General case' 0 C--O 1.288 3.091 0 CA-C-O 124.72 2.2 . . . . 27.44 110.141 156.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -52.93 -52.24 58.5 Favored 'General case' 0 C--O 1.255 1.342 0 CA-C-N 112.442 -2.163 . . . . 43.23 111.641 -170.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 35.5 p30 -164.17 -174.8 3.69 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-O 122.091 0.948 . . . . 25.7 110.04 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -58.71 -29.2 66.49 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 116.466 2.024 . . . . 28.46 116.466 -178.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -57.04 -42.02 79.72 Favored 'General case' 0 N--CA 1.51 2.571 0 C-N-CA 118.647 -1.221 . . . . 27.48 112.751 170.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . 0.444 ' CD1' ' CD2' ' A' ' 117' ' ' HIS . 23.4 mm -67.63 -35.91 74.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.048 0 N-CA-C 113.801 1.037 . . . . 22.96 113.801 178.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 84.5 t -66.06 -47.65 84.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.756 0 N-CA-C 104.472 -2.418 . . . . 26.35 104.472 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.34 37.97 Favored 'General case' 0 N--CA 1.52 3.037 0 CA-C-O 122.961 1.362 . . . . 26.03 112.911 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tt -38.25 -53.95 1.43 Allowed 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.273 1.212 . . . . 39.52 114.273 168.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -65.48 -47.85 74.66 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.47 1.656 . . . . 28.92 115.47 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -69.9 -45.72 66.98 Favored 'General case' 0 C--O 1.192 -1.931 0 N-CA-C 108.142 -1.058 . . . . 38.9 108.142 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -61.62 -38.37 87.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.465 -0.788 . . . . 32.89 112.295 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.5 65.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 118.257 0.48 . . . . 28.84 110.605 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.4 78.35 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 119.068 -1.053 . . . . 30.17 110.924 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -63.23 -43.29 98.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 123.571 0.545 . . . . 38.67 111.239 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -62.74 -31.8 72.81 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 122.867 1.318 . . . . 37.55 110.404 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.23 -37.74 75.07 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 119.942 -1.724 . . . . 43.86 112.377 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -98.07 5.56 48.56 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 116.113 1.894 . . . . 44.28 116.113 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLU . . . . . 0.536 ' OE2' ' NH2' ' A' ' 87' ' ' ARG . 19.1 pt-20 -87.66 178.39 6.77 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.814 0.696 . . . . 45.83 111.213 -168.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . . . 25.39 -122.64 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 126.503 2.377 . . . . 54.77 111.364 147.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 115.932 -1.985 . . . . 71.21 112.887 179.905 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1005 ' ' HOH . . . . . 0.51 ' O ' ' NH1' ' A' ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1040 ' ' HOH . . . . . 0.764 ' O ' ' NE2' ' B' ' 34' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1057 ' ' HOH . . . . . 0.409 ' O ' ' NH1' ' B' ' 57' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD22 HH12 ' B' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 123.259 1.504 . . . . 66.890000000000001 113.689 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -108.43 135.32 49.91 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 113.158 -1.837 . . . . 69.510000000000005 111.663 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.05 154.91 37.74 Favored 'General case' 0 CA--C 1.486 -1.484 0 CA-C-N 114.399 -1.273 . . . . 50.310000000000002 107.914 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 pt -58.08 149.66 4.88 Favored 'Isoleucine or valine' 0 C--O 1.258 1.524 0 C-N-CA 119.106 -1.038 . . . . 42.799999999999997 111.383 169.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.65 140.2 38.46 Favored Pre-proline 0 C--O 1.212 -0.877 0 CA-C-N 114.451 -1.25 . . . . 41.119999999999997 111.754 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -45.44 -42.7 17.91 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-O 116.568 -1.513 . . . . 42.079999999999998 115.082 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -39.52 93.67 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.455 1.48 . . . . 57.509999999999998 112.401 -179.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.8 t -63.11 -42.96 98.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 114.353 -1.294 . . . . 34.689999999999998 110.658 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.06 99.17 Favored 'General case' 0 C--O 1.259 1.57 0 N-CA-C 112.981 0.734 . . . . 32.049999999999997 112.981 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -69.94 -35.82 74.83 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 107.687 -1.227 . . . . 45.049999999999997 107.687 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.2 m -72.37 -39.37 68.12 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 119.197 0.908 . . . . 33.969999999999999 109.733 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.4 tp -64.48 -37.87 89.06 Favored 'General case' 0 C--O 1.261 1.665 0 CA-C-O 121.828 0.823 . . . . 31.57 108.941 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.07 -47.17 81.65 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.597 1.189 . . . . 25.149999999999999 113.631 171.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.61 -30.01 71.03 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.527 -1.269 . . . . 43.479999999999997 114.358 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . 0.625 ' O ' HG12 ' A' ' 42' ' ' VAL . 54.3 t80 -76.2 -43.84 40.58 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 125.054 1.471 . . . . 32.119999999999997 112.566 -179.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.87 -42.09 92.96 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 115.717 1.747 . . . . 27.98 115.717 168.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.98 -48.19 21.71 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.703 1.371 . . . . 24.530000000000001 114.703 170.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . 0.701 HG21 HD13 ' A' ' 86' ' ' LEU . 4.3 p -60.32 -34.64 58.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.956 -0.698 . . . . 34.890000000000001 112.753 174.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.05 -16.47 63.71 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 115.671 1.73 . . . . 29.760000000000002 115.671 173.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.37 48.22 1.37 Allowed 'General case' 0 C--O 1.205 -1.252 0 CA-C-O 122.154 0.978 . . . . 31.829999999999998 111.929 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 31.8 t70 -144.93 117.76 5.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 107.62 -1.252 . . . . 42.439999999999998 107.62 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 45' ' ' ASP . 22.3 Cg_exo -61.46 -32.66 88.79 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 CA-C-O 117.572 -1.095 . . . . 29.510000000000002 114.926 -175.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -69.99 -47.32 62.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.987 0.812 . . . . 36.659999999999997 109.582 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . 0.552 ' NH1' HG23 ' A' ' 42' ' ' VAL . 77.3 mtt180 -52.65 -44.94 66.48 Favored 'General case' 0 C--O 1.283 2.826 0 CA-C-O 122.402 1.096 . . . . 57.950000000000003 113.871 171.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.5 -30.69 71.77 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 114.693 -1.139 . . . . 25.670000000000002 111.72 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . 0.432 ' O ' ' OG ' ' A' ' 53' ' ' SER . 11.0 mtp180 -65.71 -46.68 78.08 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 123.34 0.656 . . . . 43.670000000000002 110.535 177.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 80' ' ' LEU . 70.8 mt -57.62 -49.58 75.98 Favored 'General case' 0 CA--C 1.478 -1.82 0 O-C-N 123.425 0.453 . . . . 37.109999999999999 111.402 175.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.01 -31.13 71.48 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 113.71 1.004 . . . . 38.530000000000001 113.71 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 50' ' ' ARG . 34.2 p -62.09 -31.72 72.2 Favored 'General case' 0 C--O 1.178 -2.665 0 C-N-CA 119.507 -0.877 . . . . 32.009999999999998 109.842 175.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 61.8 mt -75.49 -56.99 4.16 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.633 -0.877 . . . . 38.380000000000003 108.633 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.48 -23.42 10.2 Favored 'General case' 0 C--O 1.195 -1.807 0 N-CA-C 113.38 0.881 . . . . 36.960000000000001 113.38 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.98 -27.63 69.26 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.828 1.418 . . . . 45.450000000000003 114.828 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 54' ' ' LEU . 9.5 ptt180 -94.15 -25.45 17.12 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 119.029 -0.51 . . . . 72.909999999999997 110.587 -177.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -171.71 163.34 6.48 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 118.987 0.812 . . . . 51.5 112.41 175.796 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 58' ' ' SER . 5.9 pt-20 -69.52 153.3 43.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.646 -0.872 . . . . 63.359999999999999 108.646 165.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 22.4 mt -155.92 150.93 26.42 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.258 -1.015 . . . . 53.670000000000002 108.258 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . . . -73.6 160.0 32.27 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 113.016 0.747 . . . . 52.0 113.016 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 0.487 ' O ' HG21 ' A' ' 76' ' ' VAL . 7.4 t -42.78 -41.47 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 116.79 2.144 . . . . 56.020000000000003 116.79 167.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -86.5 -23.73 42.2 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 117.539 1.775 . . . . 54.130000000000003 117.539 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -68.07 -31.09 70.48 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 119.556 -2.143 . . . . 56.950000000000003 110.186 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.2 mt -75.88 -46.09 32.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.401 1.08 . . . . 58.719999999999999 109.62 -174.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.03 -40.08 72.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.758 -1.11 . . . . 61.280000000000001 111.086 172.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -73.52 -25.51 60.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.644 -0.66 . . . . 66.209999999999994 112.476 -178.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.75 -43.14 31.79 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.417 0.895 . . . . 61.75 113.417 172.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.6 mm -80.72 -6.57 9.78 Favored 'Isoleucine or valine' 0 C--O 1.255 1.394 0 N-CA-C 108.471 -0.937 . . . . 62.840000000000003 108.471 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.59 61.7 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-O 118.291 -1.283 . . . . 66.010000000000005 114.676 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.3 m -128.51 -161.7 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 117.988 0.894 . . . . 68.189999999999998 110.312 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.415 ' O ' HG22 ' A' ' 76' ' ' VAL . 53.4 p -93.09 177.78 5.95 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 115.25 1.574 . . . . 72.400000000000006 115.25 -170.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.83 -59.53 2.56 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.313 -0.858 . . . . 78.280000000000001 109.203 178.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -5.92 0.95 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.77 1.026 . . . . 75.870000000000005 113.77 179.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.63 9.25 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.976 1.473 . . . . 75.159999999999997 114.976 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -67.0 -40.45 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 105.427 -2.064 . . . . 72.319999999999993 105.427 170.951 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.8 m -74.42 4.18 6.33 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 114.434 -1.257 . . . . 75.469999999999999 112.248 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -96.9 -37.98 10.0 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 121.688 -0.632 . . . . 75.879999999999995 110.171 167.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -80.58 -35.32 34.4 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.702 -0.681 . . . . 73.939999999999998 110.444 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' CD1' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -70.1 -55.57 9.11 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.392 -0.966 . . . . 70.950000000000003 108.392 -177.498 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -51.99 -12.93 0.25 Allowed 'General case' 0 CA--C 1.55 0.979 0 O-C-N 124.803 1.314 . . . . 80.400000000000006 114.021 168.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . 0.47 ' OG ' ' NH2' ' A' ' 48' ' ' ARG . 23.1 t -83.18 -51.54 7.4 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.556 -0.858 . . . . 66.769999999999996 109.365 164.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' A' ' 86' ' ' LEU . 4.7 mt -67.54 -15.37 63.62 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 113.332 0.864 . . . . 66.840000000000003 113.332 -172.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.532 ' HG3' ' N ' ' A' ' 85' ' ' ASN . 35.6 ptt180 -72.05 -58.1 3.72 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 104.246 -2.502 . . . . 78.790000000000006 104.246 -178.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . 0.532 ' N ' ' HG3' ' A' ' 84' ' ' ARG . 7.1 p30 -61.75 -14.16 29.81 Favored 'General case' 0 C--O 1.262 1.742 0 N-CA-C 113.215 0.82 . . . . 70.280000000000001 113.215 -178.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . 0.701 HD13 HG21 ' A' ' 42' ' ' VAL . 11.5 mt -88.39 -20.1 25.72 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.943 -1.026 . . . . 58.130000000000003 113.38 177.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . 0.534 ' NH2' ' OE2' ' B' ' 120' ' ' GLU . 25.5 mtp-105 90.47 26.54 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.202 0 CA-C-O 122.725 1.25 . . . . 56.579999999999998 112.588 170.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -98.57 -38.6 9.08 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 113.68 -1.6 . . . . 44.43 109.578 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.67 154.08 31.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.042 0 N-CA-C 116.788 2.144 . . . . 40.969999999999999 116.788 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 69.5 p -124.52 163.55 21.65 Favored 'General case' 0 C--O 1.204 -1.315 0 CA-C-N 116.085 -0.507 . . . . 47.210000000000001 110.026 173.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 99' ' ' TYR . 20.5 p90 -143.28 149.75 38.29 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 117.23 2.308 . . . . 71.5 117.23 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 124.072 1.892 . . . . 60.030000000000001 107.505 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . 0.416 ' ND1' ' N ' ' A' ' 97' ' ' HIS 0.281 0.0 OUTLIER . . . . . 1 N--CA 1.54 4.043 0 CA-C-O 124.614 2.149 . . . . 76.709999999999994 113.002 . . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.22 153.77 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 1 CA-C-N 107.957 -4.201 . . . . 64.120000000000005 107.44 -176.504 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . 0.423 ' O ' ' HA ' ' A' ' 91' ' ' TYR . 58.1 m-85 -119.5 135.39 54.79 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.135 -0.691 . . . . 68.989999999999995 109.135 169.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -111.46 145.02 39.74 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-O 122.664 1.221 . . . . 48.109999999999999 113.8 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -136.7 165.29 26.25 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-N 111.741 -2.481 . . . . 46.630000000000003 111.262 170.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 34.1 mt -61.73 131.68 50.7 Favored 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 106.804 -1.554 . . . . 37.07 106.804 163.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -46.21 -46.56 17.65 Favored 'General case' 0 C--O 1.21 -0.983 0 C-N-CA 125.29 1.436 . . . . 57.149999999999999 112.565 -171.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -170.52 179.58 3.28 Favored 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 123.719 0.808 . . . . 41.109999999999999 110.838 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 15.5 p-80 -51.59 -28.98 15.73 Favored 'General case' 0 CA--C 1.59 2.509 0 O-C-N 125.906 2.004 . . . . 46.270000000000003 113.99 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -67.72 -47.38 69.51 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.117 1.781 . . . . 33.600000000000001 111.239 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . 0.407 ' N ' HD13 ' A' ' 107' ' ' ILE . 5.5 mm -55.92 -44.72 78.92 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 113.867 -1.515 . . . . 30.5 114.701 171.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.4 t -60.63 -46.74 95.24 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 N-CA-C 108.536 -0.913 . . . . 36.240000000000002 108.536 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.41 -42.85 87.2 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.726 1.21 . . . . 34.030000000000001 108.182 -169.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.5 tp -64.0 -54.74 29.61 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.467 2.307 . . . . 38.960000000000001 110.345 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -56.04 -44.58 78.95 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 116.089 1.885 . . . . 33.530000000000001 116.089 173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -69.77 -42.55 73.69 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 123.285 1.516 . . . . 37.43 114.346 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -63.84 -43.1 97.17 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.946 -1.024 . . . . 29.649999999999999 111.445 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.59 -49.71 76.72 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.438 -0.801 . . . . 22.129999999999999 111.462 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.2 tp -72.28 -41.16 66.98 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 114.729 -1.123 . . . . 26.949999999999999 111.693 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.9 -43.88 94.57 Favored 'General case' 0 N--CA 1.513 2.722 0 C-N-CA 118.885 -1.126 . . . . 44.420000000000002 113.833 169.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HIS . . . . . 0.869 ' CD2' HD11 ' B' ' 107' ' ' ILE . 74.6 t60 -61.84 -42.8 99.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.708 -1.197 . . . . 29.940000000000001 110.502 -179.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.6 tp -63.8 -27.38 69.14 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.645 1.212 . . . . 35.700000000000003 111.189 179.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -74.65 -28.39 60.84 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-N 115.021 -0.99 . . . . 49.420000000000002 112.847 -177.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.22 -36.41 41.55 Favored 'General case' 0 C--O 1.197 -1.658 0 C-N-CA 123.831 0.852 . . . . 45.619999999999997 109.573 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' 1016 ' ' HOH . . . . . . . . 0 C--O 1.276 2.462 0 CA-C-O 123.945 1.831 . . . . 58.390000000000001 113.258 170.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLN . . . . . 0.424 ' O ' ' HB3' ' B' ' 27' ' ' ALA . 49.4 tt0 . . . . . 0 N--CA 1.534 3.762 0 CA-C-O 122.23 1.014 . . . . 62.890000000000001 113.073 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 26' ' ' GLN . . . 80.19 116.39 0.06 Allowed 'General case' 0 C--O 1.275 2.433 0 CA-C-O 123.73 1.729 . . . . 45.939999999999998 110.718 -165.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 43.2 pt -54.41 152.94 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 111.819 -2.446 . . . . 35.289999999999999 112.927 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.85 150.38 97.82 Favored Pre-proline 0 CA--C 1.469 -2.142 0 N-CA-C 106.544 -1.65 . . . . 29.449999999999999 106.544 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -48.98 -42.74 37.66 Favored 'Trans proline' 0 CA--C 1.569 2.269 0 C-N-CA 121.855 1.703 . . . . 29.510000000000002 113.564 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -44.79 85.64 Favored 'General case' 0 C--O 1.195 -1.769 0 C-N-CA 125.758 1.623 . . . . 41.920000000000002 108.731 -177.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.35 -40.08 87.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.882 0 N-CA-C 108.323 -0.992 . . . . 30.559999999999999 108.323 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.68 -38.7 90.01 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.042 1.877 . . . . 21.949999999999999 113.47 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLN . . . . . 0.553 ' OE1' ' O ' ' B' 1040 ' ' HOH . 51.1 tp60 -62.78 -46.76 86.49 Favored 'General case' 0 N--CA 1.396 -3.131 0 CA-C-N 113.897 -1.501 . . . . 27.629999999999999 112.41 173.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 31.7 m -60.4 -44.41 95.71 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 113.958 1.095 . . . . 23.859999999999999 113.958 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.5 tp -62.5 -38.63 90.64 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 116.974 -1.488 . . . . 18.920000000000002 111.356 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.98 -39.99 96.39 Favored 'General case' 1 C--O 1.146 -4.376 0 CA-C-N 121.231 1.832 . . . . 11.970000000000001 110.322 178.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 34' ' ' GLN . 92.4 mt-10 -63.52 -38.75 92.33 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 126.936 2.094 . . . . 35.450000000000003 112.663 174.745 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PHE . . . . . 0.536 ' HE2' HD11 ' B' ' 110' ' ' LEU . 63.9 t80 -58.69 -46.88 86.27 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-N 119.737 1.153 . . . . 15.94 112.385 168.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -70.1 -33.63 72.11 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 115.107 1.521 . . . . 24.010000000000002 115.107 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.03 -44.75 71.27 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-O 123.19 1.471 . . . . 18.510000000000002 114.031 171.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 64.5 t -53.01 -40.31 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 120.099 -1.625 . . . . 25.109999999999999 113.024 168.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . 0.584 HD21 HD22 ' B' ' 88' ' ' LEU . 39.4 mt -77.64 -16.35 58.6 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 123.977 1.846 . . . . 17.710000000000001 112.661 -176.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.8 44.71 0.93 Allowed 'General case' 0 C--O 1.291 3.254 0 N-CA-C 116.129 1.9 . . . . 29.309999999999999 116.129 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASP . . . . . 0.559 ' OD2' ' HG3' ' B' ' 48' ' ' ARG . 3.5 t70 -134.43 133.61 21.74 Favored Pre-proline 0 C--O 1.193 -1.894 0 CA-C-O 118.079 -0.962 . . . . 43.759999999999998 110.672 169.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.97 -46.81 17.59 Favored 'Trans proline' 0 C--O 1.206 -1.095 0 C-N-CA 121.726 1.617 . . . . 23.75 113.382 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -61.23 -43.02 99.56 Favored 'General case' 0 C--O 1.185 -2.296 0 N-CA-C 113.731 1.011 . . . . 39.539999999999999 113.731 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ARG . . . . . 0.559 ' HG3' ' OD2' ' B' ' 45' ' ' ASP . 71.8 mtm-85 -63.92 -37.45 87.44 Favored 'General case' 0 CA--C 1.563 1.454 0 CA-C-N 120.001 1.273 . . . . 42.600000000000001 111.129 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 24.3 mt -67.19 -33.5 75.53 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.045 0.938 . . . . 23.149999999999999 110.982 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -65.03 -43.02 93.79 Favored 'General case' 0 N--CA 1.423 -1.8 0 O-C-N 123.692 0.62 . . . . 42.579999999999998 110.638 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.04 -52.39 65.47 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 114.177 1.177 . . . . 30.75 114.177 171.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.0 mt -53.77 -36.52 62.48 Favored 'General case' 0 CA--C 1.559 1.305 0 N-CA-C 117.769 2.507 . . . . 24.960000000000001 117.769 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 21.6 p -62.72 -35.28 79.24 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-O 121.296 0.569 . . . . 27.870000000000001 110.457 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 49.4 mt -75.35 -47.59 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 120.279 -0.568 . . . . 22.629999999999999 110.299 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.72 -17.5 64.18 Favored 'General case' 0 C--O 1.19 -2.056 0 O-C-N 121.907 -0.496 . . . . 22.940000000000001 112.241 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.99 -29.55 69.95 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.844 1.257 . . . . 34.149999999999999 109.345 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ARG . . . . . 0.676 HH12 HD22 ' A' ' 25' ' ' LEU . 17.8 mtp-105 -119.64 91.66 3.6 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 125.432 1.493 . . . . 73.549999999999997 107.567 172.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' SER . . . . . 0.612 ' HB3' ' O ' ' B' ' 57' ' ' ARG . 22.8 t 93.91 135.74 0.02 OUTLIER 'General case' 0 C--O 1.26 1.612 0 N-CA-C 116.883 2.179 . . . . 42.780000000000001 116.883 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLU . . . . . 0.538 ' OE1' ' HD3' ' B' ' 92' ' ' ARG . 12.1 pt-20 -72.1 130.55 41.16 Favored 'General case' 0 N--CA 1.416 -2.149 0 CA-C-N 110.824 -2.898 . . . . 34.640000000000001 103.972 168.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' B' ' 64' ' ' ASP . 19.6 mt -134.82 160.14 39.16 Favored 'General case' 0 C--O 1.255 1.344 0 N-CA-C 112.548 0.573 . . . . 28.57 112.548 177.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . . . -83.79 163.8 19.94 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 104.752 -2.314 . . . . 28.190000000000001 104.752 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . 0.466 HG12 ' HG3' ' B' ' 73' ' ' GLU . 81.9 t -58.12 -35.32 52.27 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 125.25 1.594 . . . . 25.399999999999999 110.714 166.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.09 -46.97 56.57 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 106.432 -2.667 . . . . 27.07 106.432 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HB3' ' B' ' 60' ' ' LEU . 54.9 m-20 -61.23 -45.74 93.28 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.741 0.906 . . . . 38.350000000000001 109.742 176.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 27.7 mt -57.35 -47.43 81.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.745 0.646 . . . . 27.800000000000001 112.745 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.68 -42.56 86.35 Favored 'General case' 0 C--O 1.25 1.1 0 N-CA-C 114.926 1.454 . . . . 35.060000000000002 114.926 -176.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -52.06 64.76 Favored 'General case' 0 C--O 1.271 2.186 0 N-CA-C 112.305 0.483 . . . . 60.789999999999999 112.305 171.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.32 71.27 Favored 'General case' 0 C--O 1.185 -2.3 0 N-CA-C 115.76 1.763 . . . . 37.109999999999999 115.76 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ILE . . . . . 0.417 HG22 HG13 ' B' ' 71' ' ' VAL . 23.2 mm -93.25 -27.43 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.668 -1.27 . . . . 41.170000000000002 111.338 -179.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.95 39.41 7.01 Favored Glycine 0 CA--C 1.533 1.185 0 O-C-N 121.361 -0.837 . . . . 44.0 114.683 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . 0.417 HG13 HG22 ' B' ' 69' ' ' ILE . 31.5 m -137.47 178.88 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.675 0 N-CA-C 105.088 -2.19 . . . . 43.689999999999998 105.088 -174.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . 0.903 ' O ' ' CB ' ' B' ' 73' ' ' GLU . 46.7 p -73.28 -26.57 61.14 Favored 'General case' 0 C--O 1.222 -0.361 1 N-CA-C 121.814 4.005 . . . . 44.030000000000001 121.814 -165.478 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . 0.903 ' CB ' ' O ' ' B' ' 72' ' ' SER . 5.9 tt0 104.13 -53.59 0.0 OUTLIER 'General case' 0 C--O 1.184 -2.364 0 CA-C-N 123.507 2.867 . . . . 46.030000000000001 106.116 -171.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 27.9 t -66.37 -33.94 76.85 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.135 -1.061 . . . . 36.700000000000003 108.135 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.66 83.73 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.614 1.196 . . . . 28.850000000000001 110.954 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' VAL . . . . . 0.7 HG12 HD22 ' B' ' 80' ' ' LEU . 85.0 t -71.0 -51.41 35.58 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.075 0 CA-C-O 123.127 1.441 . . . . 26.460000000000001 111.709 -179.903 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 7.9 t -53.3 -43.57 67.65 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 126.671 1.989 . . . . 28.25 111.738 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -64.72 -47.59 77.76 Favored 'General case' 0 CA--C 1.606 3.106 0 CA-C-N 115.412 -0.813 . . . . 39.140000000000001 110.459 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.12 -35.28 73.18 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.086 1.513 . . . . 37.68 115.086 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . 0.7 HD22 HG12 ' B' ' 76' ' ' VAL . 0.0 OUTLIER -72.3 -18.42 61.79 Favored 'General case' 0 CA--C 1.576 1.966 0 O-C-N 121.067 -1.021 . . . . 27.039999999999999 110.996 -176.911 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 8.9 mtp85 -63.21 -47.03 84.26 Favored 'General case' 0 N--CA 1.424 -1.761 0 O-C-N 120.41 -1.431 . . . . 61.969999999999999 111.398 -172.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 64.3 p -81.23 -21.87 39.18 Favored 'General case' 0 N--CA 1.395 -3.184 0 N-CA-C 106.926 -1.509 . . . . 33.009999999999998 106.926 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 62.1 mt -67.13 -31.84 72.56 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 120.378 -1.451 . . . . 28.010000000000002 112.331 170.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -74.42 -55.04 6.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 121.776 0.798 . . . . 40.909999999999997 111.076 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -53.48 -41.39 66.18 Favored 'General case' 0 C--O 1.178 -2.691 0 CA-C-N 114.967 -1.015 . . . . 42.100000000000001 111.708 -176.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.65 9.97 27.59 Favored 'General case' 0 C--O 1.199 -1.554 0 O-C-N 119.616 -1.927 . . . . 36.880000000000003 110.072 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . 0.468 ' HD3' ' O ' ' B' 1002 ' ' HOH . 8.5 mtp-105 59.4 37.14 23.32 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 115.88 1.808 . . . . 41.229999999999997 115.88 174.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' LEU . . . . . 0.584 HD22 HD21 ' B' ' 43' ' ' LEU . 1.5 mp -72.84 -30.94 64.42 Favored 'General case' 0 CA--C 1.49 -1.352 0 O-C-N 124.612 1.195 . . . . 29.289999999999999 113.534 165.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.48 152.59 33.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 106.965 -1.495 . . . . 26.789999999999999 106.965 -177.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 99.3 p -125.19 177.91 5.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.126 -1.064 . . . . 29.460000000000001 108.126 167.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -143.84 149.2 36.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.175 0.806 . . . . 37.979999999999997 113.175 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ARG . . . . . 0.538 ' HD3' ' OE1' ' B' ' 59' ' ' GLU . 5.2 ptm180 -113.66 149.68 34.29 Favored 'General case' 0 CA--C 1.555 1.135 0 O-C-N 124.629 1.206 . . . . 40.710000000000001 110.674 166.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . 0.296 7.9 ptpt -95.14 132.9 39.56 Favored 'General case' 0 C--O 1.268 2.049 0 N-CA-C 115.852 1.797 . . . . 50.469999999999999 115.852 162.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -127.17 103.35 7.38 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 112.717 -2.038 . . . . 40.399999999999999 108.037 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 55.08 -114.49 4.64 Favored Glycine 0 CA--C 1.546 2.003 0 CA-C-O 122.676 1.153 . . . . 34.649999999999999 110.245 -173.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -94.09 -4.25 49.68 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 115.814 1.783 . . . . 64.450000000000003 115.814 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -89.48 140.36 29.61 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 123.718 1.723 . . . . 47.890000000000001 107.219 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 30.6 t -113.22 119.25 60.21 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 113.63 -1.623 . . . . 31.039999999999999 111.653 165.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -111.88 128.95 56.29 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.582 -1.266 . . . . 51.439999999999998 107.582 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -98.13 150.15 21.76 Favored 'General case' 0 C--O 1.25 1.132 0 CA-C-N 113.462 -1.699 . . . . 26.75 108.265 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' B' 1007 ' ' HOH . 67.7 mt-30 -140.94 158.2 44.28 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 113.795 -1.548 . . . . 42.280000000000001 111.255 172.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 81.6 mt -51.17 132.12 28.06 Favored 'General case' 0 C--O 1.288 3.091 0 CA-C-O 124.72 2.2 . . . . 27.440000000000001 110.141 156.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLN . . . . . 0.527 ' HG2' ' CE1' ' A' ' 117' ' ' HIS . 35.5 tp60 -52.93 -52.24 58.5 Favored 'General case' 0 C--O 1.255 1.342 0 CA-C-N 112.442 -2.163 . . . . 43.229999999999997 111.641 -170.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 35.5 p30 -164.17 -174.8 3.69 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-O 122.091 0.948 . . . . 25.699999999999999 110.04 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -58.71 -29.2 66.49 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 116.466 2.024 . . . . 28.460000000000001 116.466 -178.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -57.04 -42.02 79.72 Favored 'General case' 0 N--CA 1.51 2.571 0 C-N-CA 118.647 -1.221 . . . . 27.48 112.751 170.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . 0.869 HD11 ' CD2' ' A' ' 117' ' ' HIS . 23.4 mm -67.63 -35.91 74.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.048 0 N-CA-C 113.801 1.037 . . . . 22.960000000000001 113.801 178.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 84.5 t -66.06 -47.65 84.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.756 0 N-CA-C 104.472 -2.418 . . . . 26.350000000000001 104.472 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.34 37.97 Favored 'General case' 0 N--CA 1.52 3.037 0 CA-C-O 122.961 1.362 . . . . 26.030000000000001 112.911 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . 0.536 HD11 ' HE2' ' B' ' 39' ' ' PHE . 3.1 tt -38.25 -53.95 1.43 Allowed 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.273 1.212 . . . . 39.520000000000003 114.273 168.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -65.48 -47.85 74.66 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.47 1.656 . . . . 28.920000000000002 115.47 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -69.9 -45.72 66.98 Favored 'General case' 0 C--O 1.192 -1.931 0 N-CA-C 108.142 -1.058 . . . . 38.899999999999999 108.142 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -61.62 -38.37 87.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.465 -0.788 . . . . 32.890000000000001 112.295 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.5 65.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 118.257 0.48 . . . . 28.84 110.605 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.4 78.35 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 119.068 -1.053 . . . . 30.170000000000002 110.924 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -63.23 -43.29 98.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 123.571 0.545 . . . . 38.670000000000002 111.239 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -62.74 -31.8 72.81 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 122.867 1.318 . . . . 37.549999999999997 110.404 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.23 -37.74 75.07 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 119.942 -1.724 . . . . 43.859999999999999 112.377 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -98.07 5.56 48.56 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 116.113 1.894 . . . . 44.280000000000001 116.113 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' OE2' ' NH2' ' A' ' 87' ' ' ARG . 19.1 pt-20 -87.66 178.39 6.77 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.814 0.696 . . . . 45.829999999999998 111.213 -168.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . . . 25.39 -122.64 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 126.503 2.377 . . . . 54.770000000000003 111.364 147.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 115.932 -1.985 . . . . 71.209999999999994 112.887 179.905 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 501' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1005 ' ' HOH . . . . . 0.489 ' O ' ' HD2' ' A' ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1016 ' ' HOH . . . . . 0.474 ' O ' ' HA ' ' A' ' 121' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1002 ' ' HOH . . . . . 0.468 ' O ' ' HD3' ' B' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1007 ' ' HOH . . . . . 0.555 ' O ' ' HG3' ' B' ' 101' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1040 ' ' HOH . . . . . 0.553 ' O ' ' OE1' ' B' ' 34' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1057 ' ' HOH . . . . . 0.409 ' O ' ' NH1' ' B' ' 57' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD22 HH12 ' B' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 123.259 1.504 . . . . 66.890000000000001 113.689 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -108.43 135.32 49.91 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 113.158 -1.837 . . . . 69.510000000000005 111.663 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.05 154.91 37.74 Favored 'General case' 0 CA--C 1.486 -1.484 0 CA-C-N 114.399 -1.273 . . . . 50.310000000000002 107.914 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 pt -58.08 149.66 4.88 Favored 'Isoleucine or valine' 0 C--O 1.258 1.524 0 C-N-CA 119.106 -1.038 . . . . 42.799999999999997 111.383 169.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.65 140.2 38.46 Favored Pre-proline 0 C--O 1.212 -0.877 0 CA-C-N 114.451 -1.25 . . . . 41.119999999999997 111.754 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -45.44 -42.7 17.91 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-O 116.568 -1.513 . . . . 42.079999999999998 115.082 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -39.52 93.67 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.455 1.48 . . . . 57.509999999999998 112.401 -179.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.8 t -63.11 -42.96 98.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 114.353 -1.294 . . . . 34.689999999999998 110.658 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.06 99.17 Favored 'General case' 0 C--O 1.259 1.57 0 N-CA-C 112.981 0.734 . . . . 32.049999999999997 112.981 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -69.94 -35.82 74.83 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 107.687 -1.227 . . . . 45.049999999999997 107.687 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.2 m -72.37 -39.37 68.12 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 119.197 0.908 . . . . 33.969999999999999 109.733 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.4 tp -64.48 -37.87 89.06 Favored 'General case' 0 C--O 1.261 1.665 0 CA-C-O 121.828 0.823 . . . . 31.57 108.941 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.07 -47.17 81.65 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.597 1.189 . . . . 25.149999999999999 113.631 171.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.61 -30.01 71.03 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.527 -1.269 . . . . 43.479999999999997 114.358 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.625 ' O ' HG12 ' A' ' 42' ' ' VAL . 54.3 t80 -76.2 -43.84 40.58 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 125.054 1.471 . . . . 32.119999999999997 112.566 -179.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.87 -42.09 92.96 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 115.717 1.747 . . . . 27.98 115.717 168.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.98 -48.19 21.71 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.703 1.371 . . . . 24.530000000000001 114.703 170.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.701 HG21 HD13 ' A' ' 86' ' ' LEU . 4.3 p -60.32 -34.64 58.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.956 -0.698 . . . . 34.890000000000001 112.753 174.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.05 -16.47 63.71 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 115.671 1.73 . . . . 29.760000000000002 115.671 173.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.37 48.22 1.37 Allowed 'General case' 0 C--O 1.205 -1.252 0 CA-C-O 122.154 0.978 . . . . 31.829999999999998 111.929 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 31.8 t70 -144.93 117.76 5.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 107.62 -1.252 . . . . 42.439999999999998 107.62 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 45' ' ' ASP . 22.3 Cg_exo -61.46 -32.66 88.79 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 CA-C-O 117.572 -1.095 . . . . 29.510000000000002 114.926 -175.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -69.99 -47.32 62.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.987 0.812 . . . . 36.659999999999997 109.582 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.552 ' NH1' HG23 ' A' ' 42' ' ' VAL . 77.3 mtt180 -52.65 -44.94 66.48 Favored 'General case' 0 C--O 1.283 2.826 0 CA-C-O 122.402 1.096 . . . . 57.950000000000003 113.871 171.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.5 -30.69 71.77 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 114.693 -1.139 . . . . 25.670000000000002 111.72 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.432 ' O ' ' OG ' ' A' ' 53' ' ' SER . 11.0 mtp180 -65.71 -46.68 78.08 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 123.34 0.656 . . . . 43.670000000000002 110.535 177.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.564 HD13 ' CD1' ' A' ' 80' ' ' LEU . 70.8 mt -57.62 -49.58 75.98 Favored 'General case' 0 CA--C 1.478 -1.82 0 O-C-N 123.425 0.453 . . . . 37.109999999999999 111.402 175.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.01 -31.13 71.48 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 113.71 1.004 . . . . 38.530000000000001 113.71 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 50' ' ' ARG . 34.2 p -62.09 -31.72 72.2 Favored 'General case' 0 C--O 1.178 -2.665 0 C-N-CA 119.507 -0.877 . . . . 32.009999999999998 109.842 175.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 61.8 mt -75.49 -56.99 4.16 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.633 -0.877 . . . . 38.380000000000003 108.633 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.48 -23.42 10.2 Favored 'General case' 0 C--O 1.195 -1.807 0 N-CA-C 113.38 0.881 . . . . 36.960000000000001 113.38 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.98 -27.63 69.26 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 114.828 1.418 . . . . 45.450000000000003 114.828 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 54' ' ' LEU . 9.5 ptt180 -94.15 -25.45 17.12 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 119.029 -0.51 . . . . 72.909999999999997 110.587 -177.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -171.71 163.34 6.48 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 118.987 0.812 . . . . 51.5 112.41 175.796 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 58' ' ' SER . 5.9 pt-20 -69.52 153.3 43.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.646 -0.872 . . . . 63.359999999999999 108.646 165.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 22.4 mt -155.92 150.93 26.42 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.258 -1.015 . . . . 53.670000000000002 108.258 -170.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . . . -73.6 160.0 32.27 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 113.016 0.747 . . . . 52.0 113.016 177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.487 ' O ' HG21 ' A' ' 76' ' ' VAL . 7.4 t -42.78 -41.47 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 116.79 2.144 . . . . 56.020000000000003 116.79 167.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -86.5 -23.73 42.2 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 117.539 1.775 . . . . 54.130000000000003 117.539 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -68.07 -31.09 70.48 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 119.556 -2.143 . . . . 56.950000000000003 110.186 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.2 mt -75.88 -46.09 32.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.401 1.08 . . . . 58.719999999999999 109.62 -174.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.03 -40.08 72.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.758 -1.11 . . . . 61.280000000000001 111.086 172.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -73.52 -25.51 60.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.644 -0.66 . . . . 66.209999999999994 112.476 -178.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.75 -43.14 31.79 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.417 0.895 . . . . 61.75 113.417 172.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.6 mm -80.72 -6.57 9.78 Favored 'Isoleucine or valine' 0 C--O 1.255 1.394 0 N-CA-C 108.471 -0.937 . . . . 62.840000000000003 108.471 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 52.92 44.59 61.7 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-O 118.291 -1.283 . . . . 66.010000000000005 114.676 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.3 m -128.51 -161.7 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 117.988 0.894 . . . . 68.189999999999998 110.312 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.415 ' O ' HG22 ' A' ' 76' ' ' VAL . 53.4 p -93.09 177.78 5.95 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 115.25 1.574 . . . . 72.400000000000006 115.25 -170.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.83 -59.53 2.56 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.313 -0.858 . . . . 78.280000000000001 109.203 178.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.52 -5.92 0.95 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.77 1.026 . . . . 75.870000000000005 113.77 179.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.63 9.25 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.976 1.473 . . . . 75.159999999999997 114.976 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -67.0 -40.45 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 105.427 -2.064 . . . . 72.319999999999993 105.427 170.951 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.8 m -74.42 4.18 6.33 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 114.434 -1.257 . . . . 75.469999999999999 112.248 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -96.9 -37.98 10.0 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 121.688 -0.632 . . . . 75.879999999999995 110.171 167.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -80.58 -35.32 34.4 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.702 -0.681 . . . . 73.939999999999998 110.444 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' CD1' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -70.1 -55.57 9.11 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 108.392 -0.966 . . . . 70.950000000000003 108.392 -177.498 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -51.99 -12.93 0.25 Allowed 'General case' 0 CA--C 1.55 0.979 0 O-C-N 124.803 1.314 . . . . 80.400000000000006 114.021 168.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . 0.47 ' OG ' ' NH2' ' A' ' 48' ' ' ARG . 23.1 t -83.18 -51.54 7.4 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.556 -0.858 . . . . 66.769999999999996 109.365 164.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' A' ' 86' ' ' LEU . 4.7 mt -67.54 -15.37 63.62 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 113.332 0.864 . . . . 66.840000000000003 113.332 -172.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.532 ' HG3' ' N ' ' A' ' 85' ' ' ASN . 35.6 ptt180 -72.05 -58.1 3.72 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 104.246 -2.502 . . . . 78.790000000000006 104.246 -178.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.532 ' N ' ' HG3' ' A' ' 84' ' ' ARG . 7.1 p30 -61.75 -14.16 29.81 Favored 'General case' 0 C--O 1.262 1.742 0 N-CA-C 113.215 0.82 . . . . 70.280000000000001 113.215 -178.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.701 HD13 HG21 ' A' ' 42' ' ' VAL . 11.5 mt -88.39 -20.1 25.72 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.943 -1.026 . . . . 58.130000000000003 113.38 177.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.534 ' NH2' ' OE2' ' B' ' 120' ' ' GLU . 25.5 mtp-105 90.47 26.54 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.202 0 CA-C-O 122.725 1.25 . . . . 56.579999999999998 112.588 170.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.1 mt -98.57 -38.6 9.08 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 113.68 -1.6 . . . . 44.43 109.578 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.67 154.08 31.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.042 0 N-CA-C 116.788 2.144 . . . . 40.969999999999999 116.788 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 69.5 p -124.52 163.55 21.65 Favored 'General case' 0 C--O 1.204 -1.315 0 CA-C-N 116.085 -0.507 . . . . 47.210000000000001 110.026 173.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 99' ' ' TYR . 20.5 p90 -143.28 149.75 38.29 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 117.23 2.308 . . . . 71.5 117.23 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 124.072 1.892 . . . . 60.030000000000001 107.505 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.63 ' CD2' ' N ' ' A' ' 97' ' ' HIS 0.281 0.0 OUTLIER . . . . . 1 N--CA 1.54 4.043 0 CA-C-O 124.614 2.149 . . . . 76.709999999999994 113.002 . . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.22 153.77 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 1 CA-C-N 107.957 -4.201 . . . . 64.120000000000005 107.44 -176.504 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.423 ' O ' ' HA ' ' A' ' 91' ' ' TYR . 58.1 m-85 -119.5 135.39 54.79 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.135 -0.691 . . . . 68.989999999999995 109.135 169.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -111.46 145.02 39.74 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-O 122.664 1.221 . . . . 48.109999999999999 113.8 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -136.7 165.29 26.25 Favored 'General case' 0 C--O 1.259 1.581 0 CA-C-N 111.741 -2.481 . . . . 46.630000000000003 111.262 170.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 34.1 mt -61.73 131.68 50.7 Favored 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 106.804 -1.554 . . . . 37.07 106.804 163.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -46.21 -46.56 17.65 Favored 'General case' 0 C--O 1.21 -0.983 0 C-N-CA 125.29 1.436 . . . . 57.149999999999999 112.565 -171.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -170.52 179.58 3.28 Favored 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 123.719 0.808 . . . . 41.109999999999999 110.838 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 15.5 p-80 -51.59 -28.98 15.73 Favored 'General case' 0 CA--C 1.59 2.509 0 O-C-N 125.906 2.004 . . . . 46.270000000000003 113.99 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -67.72 -47.38 69.51 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.117 1.781 . . . . 33.600000000000001 111.239 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.407 ' N ' HD13 ' A' ' 107' ' ' ILE . 5.5 mm -55.92 -44.72 78.92 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 113.867 -1.515 . . . . 30.5 114.701 171.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.4 t -60.63 -46.74 95.24 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 N-CA-C 108.536 -0.913 . . . . 36.240000000000002 108.536 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.41 -42.85 87.2 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.726 1.21 . . . . 34.030000000000001 108.182 -169.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.5 tp -64.0 -54.74 29.61 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 127.467 2.307 . . . . 38.960000000000001 110.345 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -56.04 -44.58 78.95 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 116.089 1.885 . . . . 33.530000000000001 116.089 173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -69.77 -42.55 73.69 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 123.285 1.516 . . . . 37.43 114.346 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -63.84 -43.1 97.17 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.946 -1.024 . . . . 29.649999999999999 111.445 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.59 -49.71 76.72 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.438 -0.801 . . . . 22.129999999999999 111.462 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 51.2 tp -72.28 -41.16 66.98 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 114.729 -1.123 . . . . 26.949999999999999 111.693 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.9 -43.88 94.57 Favored 'General case' 0 N--CA 1.513 2.722 0 C-N-CA 118.885 -1.126 . . . . 44.420000000000002 113.833 169.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.869 ' CD2' HD11 ' B' ' 107' ' ' ILE . 74.6 t60 -61.84 -42.8 99.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.708 -1.197 . . . . 29.940000000000001 110.502 -179.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.6 tp -63.8 -27.38 69.14 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.645 1.212 . . . . 35.700000000000003 111.189 179.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.478 ' N ' HE21 ' A' ' 119' ' ' GLN . 0.0 OUTLIER -74.65 -28.39 60.84 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-N 115.021 -0.99 . . . . 49.420000000000002 112.847 -177.666 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.22 -36.41 41.55 Favored 'General case' 0 C--O 1.197 -1.658 0 C-N-CA 123.831 0.852 . . . . 45.619999999999997 109.573 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' 1016 ' ' HOH . . . . . . . . 0 C--O 1.276 2.462 0 CA-C-O 123.945 1.831 . . . . 58.390000000000001 113.258 170.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.424 ' O ' ' HB3' ' B' ' 27' ' ' ALA . 49.4 tt0 . . . . . 0 N--CA 1.534 3.762 0 CA-C-O 122.23 1.014 . . . . 62.890000000000001 113.073 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 26' ' ' GLN . . . 80.19 116.39 0.06 Allowed 'General case' 0 C--O 1.275 2.433 0 CA-C-O 123.73 1.729 . . . . 45.939999999999998 110.718 -165.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 43.2 pt -54.41 152.94 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.408 -2.561 0 CA-C-N 111.819 -2.446 . . . . 35.289999999999999 112.927 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.85 150.38 97.82 Favored Pre-proline 0 CA--C 1.469 -2.142 0 N-CA-C 106.544 -1.65 . . . . 29.449999999999999 106.544 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -48.98 -42.74 37.66 Favored 'Trans proline' 0 CA--C 1.569 2.269 0 C-N-CA 121.855 1.703 . . . . 29.510000000000002 113.564 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -44.79 85.64 Favored 'General case' 0 C--O 1.195 -1.769 0 C-N-CA 125.758 1.623 . . . . 41.920000000000002 108.731 -177.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 79.2 t -65.35 -40.08 87.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.882 0 N-CA-C 108.323 -0.992 . . . . 30.559999999999999 108.323 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.68 -38.7 90.01 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.042 1.877 . . . . 21.949999999999999 113.47 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLN . . . . . 0.402 ' O ' ' HG3' ' B' ' 38' ' ' GLU . 7.2 tp-100 -62.78 -46.76 86.49 Favored 'General case' 0 N--CA 1.396 -3.131 0 CA-C-N 113.897 -1.501 . . . . 27.629999999999999 112.41 173.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 31.7 m -60.4 -44.41 95.71 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 113.958 1.095 . . . . 23.859999999999999 113.958 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.5 tp -62.5 -38.63 90.64 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 116.974 -1.488 . . . . 18.920000000000002 111.356 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.98 -39.99 96.39 Favored 'General case' 1 C--O 1.146 -4.376 0 CA-C-N 121.231 1.832 . . . . 11.970000000000001 110.322 178.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 34' ' ' GLN . 92.4 mt-10 -63.52 -38.75 92.33 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 126.936 2.094 . . . . 35.450000000000003 112.663 174.745 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PHE . . . . . 0.536 ' HE2' HD11 ' B' ' 110' ' ' LEU . 63.9 t80 -58.69 -46.88 86.27 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-N 119.737 1.153 . . . . 15.94 112.385 168.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -70.1 -33.63 72.11 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 115.107 1.521 . . . . 24.010000000000002 115.107 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.03 -44.75 71.27 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-O 123.19 1.471 . . . . 18.510000000000002 114.031 171.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 64.5 t -53.01 -40.31 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 120.099 -1.625 . . . . 25.109999999999999 113.024 168.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.584 HD21 HD22 ' B' ' 88' ' ' LEU . 39.4 mt -77.64 -16.35 58.6 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 123.977 1.846 . . . . 17.710000000000001 112.661 -176.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.8 44.71 0.93 Allowed 'General case' 0 C--O 1.291 3.254 0 N-CA-C 116.129 1.9 . . . . 29.309999999999999 116.129 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASP . . . . . 0.559 ' OD2' ' HG3' ' B' ' 48' ' ' ARG . 3.5 t70 -134.43 133.61 21.74 Favored Pre-proline 0 C--O 1.193 -1.894 0 CA-C-O 118.079 -0.962 . . . . 43.759999999999998 110.672 169.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.97 -46.81 17.59 Favored 'Trans proline' 0 C--O 1.206 -1.095 0 C-N-CA 121.726 1.617 . . . . 23.75 113.382 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -61.23 -43.02 99.56 Favored 'General case' 0 C--O 1.185 -2.296 0 N-CA-C 113.731 1.011 . . . . 39.539999999999999 113.731 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.559 ' HG3' ' OD2' ' B' ' 45' ' ' ASP . 71.8 mtm-85 -63.92 -37.45 87.44 Favored 'General case' 0 CA--C 1.563 1.454 0 CA-C-N 120.001 1.273 . . . . 42.600000000000001 111.129 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 24.3 mt -67.19 -33.5 75.53 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.045 0.938 . . . . 23.149999999999999 110.982 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -65.03 -43.02 93.79 Favored 'General case' 0 N--CA 1.423 -1.8 0 O-C-N 123.692 0.62 . . . . 42.579999999999998 110.638 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.04 -52.39 65.47 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 114.177 1.177 . . . . 30.75 114.177 171.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.0 mt -53.77 -36.52 62.48 Favored 'General case' 0 CA--C 1.559 1.305 0 N-CA-C 117.769 2.507 . . . . 24.960000000000001 117.769 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 21.6 p -62.72 -35.28 79.24 Favored 'General case' 0 C--O 1.203 -1.358 0 CA-C-O 121.296 0.569 . . . . 27.870000000000001 110.457 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 49.4 mt -75.35 -47.59 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 120.279 -0.568 . . . . 22.629999999999999 110.299 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.72 -17.5 64.18 Favored 'General case' 0 C--O 1.19 -2.056 0 O-C-N 121.907 -0.496 . . . . 22.940000000000001 112.241 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.99 -29.55 69.95 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.844 1.257 . . . . 34.149999999999999 109.345 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.676 HH12 HD22 ' A' ' 25' ' ' LEU . 17.8 mtp-105 -119.64 91.66 3.6 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 125.432 1.493 . . . . 73.549999999999997 107.567 172.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' SER . . . . . 0.612 ' HB3' ' O ' ' B' ' 57' ' ' ARG . 22.8 t 93.91 135.74 0.02 OUTLIER 'General case' 0 C--O 1.26 1.612 0 N-CA-C 116.883 2.179 . . . . 42.780000000000001 116.883 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLU . . . . . 0.538 ' OE1' ' HD3' ' B' ' 92' ' ' ARG . 12.1 pt-20 -72.1 130.55 41.16 Favored 'General case' 0 N--CA 1.416 -2.149 0 CA-C-N 110.824 -2.898 . . . . 34.640000000000001 103.972 168.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' B' ' 64' ' ' ASP . 19.6 mt -134.82 160.14 39.16 Favored 'General case' 0 C--O 1.255 1.344 0 N-CA-C 112.548 0.573 . . . . 28.57 112.548 177.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . . . -83.79 163.8 19.94 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 104.752 -2.314 . . . . 28.190000000000001 104.752 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . 0.466 HG12 ' HG3' ' B' ' 73' ' ' GLU . 81.9 t -58.12 -35.32 52.27 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 125.25 1.594 . . . . 25.399999999999999 110.714 166.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.09 -46.97 56.57 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 106.432 -2.667 . . . . 27.07 106.432 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HB3' ' B' ' 60' ' ' LEU . 54.9 m-20 -61.23 -45.74 93.28 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.741 0.906 . . . . 38.350000000000001 109.742 176.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 27.7 mt -57.35 -47.43 81.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.745 0.646 . . . . 27.800000000000001 112.745 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.68 -42.56 86.35 Favored 'General case' 0 C--O 1.25 1.1 0 N-CA-C 114.926 1.454 . . . . 35.060000000000002 114.926 -176.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -52.06 64.76 Favored 'General case' 0 C--O 1.271 2.186 0 N-CA-C 112.305 0.483 . . . . 60.789999999999999 112.305 171.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.32 71.27 Favored 'General case' 0 C--O 1.185 -2.3 0 N-CA-C 115.76 1.763 . . . . 37.109999999999999 115.76 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ILE . . . . . 0.417 HG22 HG13 ' B' ' 71' ' ' VAL . 23.2 mm -93.25 -27.43 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.668 -1.27 . . . . 41.170000000000002 111.338 -179.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.95 39.41 7.01 Favored Glycine 0 CA--C 1.533 1.185 0 O-C-N 121.361 -0.837 . . . . 44.0 114.683 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.417 HG13 HG22 ' B' ' 69' ' ' ILE . 31.5 m -137.47 178.88 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.675 0 N-CA-C 105.088 -2.19 . . . . 43.689999999999998 105.088 -174.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . 0.903 ' O ' ' CB ' ' B' ' 73' ' ' GLU . 46.7 p -73.28 -26.57 61.14 Favored 'General case' 0 C--O 1.222 -0.361 1 N-CA-C 121.814 4.005 . . . . 44.030000000000001 121.814 -165.478 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.903 ' CB ' ' O ' ' B' ' 72' ' ' SER . 5.9 tt0 104.13 -53.59 0.0 OUTLIER 'General case' 0 C--O 1.184 -2.364 0 CA-C-N 123.507 2.867 . . . . 46.030000000000001 106.116 -171.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 27.9 t -66.37 -33.94 76.85 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.135 -1.061 . . . . 36.700000000000003 108.135 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.66 83.73 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.614 1.196 . . . . 28.850000000000001 110.954 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' VAL . . . . . 0.7 HG12 HD22 ' B' ' 80' ' ' LEU . 85.0 t -71.0 -51.41 35.58 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.075 0 CA-C-O 123.127 1.441 . . . . 26.460000000000001 111.709 -179.903 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 7.9 t -53.3 -43.57 67.65 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 126.671 1.989 . . . . 28.25 111.738 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -64.72 -47.59 77.76 Favored 'General case' 0 CA--C 1.606 3.106 0 CA-C-N 115.412 -0.813 . . . . 39.140000000000001 110.459 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.12 -35.28 73.18 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.086 1.513 . . . . 37.68 115.086 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.7 HD22 HG12 ' B' ' 76' ' ' VAL . 0.0 OUTLIER -72.3 -18.42 61.79 Favored 'General case' 0 CA--C 1.576 1.966 0 O-C-N 121.067 -1.021 . . . . 27.039999999999999 110.996 -176.911 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 8.9 mtp85 -63.21 -47.03 84.26 Favored 'General case' 0 N--CA 1.424 -1.761 0 O-C-N 120.41 -1.431 . . . . 61.969999999999999 111.398 -172.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 64.3 p -81.23 -21.87 39.18 Favored 'General case' 0 N--CA 1.395 -3.184 0 N-CA-C 106.926 -1.509 . . . . 33.009999999999998 106.926 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 62.1 mt -67.13 -31.84 72.56 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 120.378 -1.451 . . . . 28.010000000000002 112.331 170.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -74.42 -55.04 6.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 121.776 0.798 . . . . 40.909999999999997 111.076 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -53.48 -41.39 66.18 Favored 'General case' 0 C--O 1.178 -2.691 0 CA-C-N 114.967 -1.015 . . . . 42.100000000000001 111.708 -176.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.65 9.97 27.59 Favored 'General case' 0 C--O 1.199 -1.554 0 O-C-N 119.616 -1.927 . . . . 36.880000000000003 110.072 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.468 ' HD3' ' O ' ' B' 1002 ' ' HOH . 8.5 mtp-105 59.4 37.14 23.32 Favored 'General case' 0 C--O 1.205 -1.277 0 N-CA-C 115.88 1.808 . . . . 41.229999999999997 115.88 174.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' LEU . . . . . 0.584 HD22 HD21 ' B' ' 43' ' ' LEU . 1.5 mp -72.84 -30.94 64.42 Favored 'General case' 0 CA--C 1.49 -1.352 0 O-C-N 124.612 1.195 . . . . 29.289999999999999 113.534 165.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.48 152.59 33.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 106.965 -1.495 . . . . 26.789999999999999 106.965 -177.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 99.3 p -125.19 177.91 5.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 108.126 -1.064 . . . . 29.460000000000001 108.126 167.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -143.84 149.2 36.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.175 0.806 . . . . 37.979999999999997 113.175 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ARG . . . . . 0.538 ' HD3' ' OE1' ' B' ' 59' ' ' GLU . 5.2 ptm180 -113.66 149.68 34.29 Favored 'General case' 0 CA--C 1.555 1.135 0 O-C-N 124.629 1.206 . . . . 40.710000000000001 110.674 166.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . 0.296 7.9 ptpt -95.14 132.9 39.56 Favored 'General case' 0 C--O 1.268 2.049 0 N-CA-C 115.852 1.797 . . . . 50.469999999999999 115.852 162.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -127.17 103.35 7.38 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 112.717 -2.038 . . . . 40.399999999999999 108.037 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 55.08 -114.49 4.64 Favored Glycine 0 CA--C 1.546 2.003 0 CA-C-O 122.676 1.153 . . . . 34.649999999999999 110.245 -173.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -94.09 -4.25 49.68 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 115.814 1.783 . . . . 64.450000000000003 115.814 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -89.48 140.36 29.61 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 123.718 1.723 . . . . 47.890000000000001 107.219 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 30.6 t -113.22 119.25 60.21 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 113.63 -1.623 . . . . 31.039999999999999 111.653 165.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -111.88 128.95 56.29 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 107.582 -1.266 . . . . 51.439999999999998 107.582 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -98.13 150.15 21.76 Favored 'General case' 0 C--O 1.25 1.132 0 CA-C-N 113.462 -1.699 . . . . 26.75 108.265 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' B' 1007 ' ' HOH . 67.7 mt-30 -140.94 158.2 44.28 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 113.795 -1.548 . . . . 42.280000000000001 111.255 172.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 81.6 mt -51.17 132.12 28.06 Favored 'General case' 0 C--O 1.288 3.091 0 CA-C-O 124.72 2.2 . . . . 27.440000000000001 110.141 156.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.527 ' HG2' ' CE1' ' A' ' 117' ' ' HIS . 3.8 tp-100 -52.93 -52.24 58.5 Favored 'General case' 0 C--O 1.255 1.342 0 CA-C-N 112.442 -2.163 . . . . 43.229999999999997 111.641 -170.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 35.5 p30 -164.17 -174.8 3.69 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-O 122.091 0.948 . . . . 25.699999999999999 110.04 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -58.71 -29.2 66.49 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 116.466 2.024 . . . . 28.460000000000001 116.466 -178.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -57.04 -42.02 79.72 Favored 'General case' 0 N--CA 1.51 2.571 0 C-N-CA 118.647 -1.221 . . . . 27.48 112.751 170.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.869 HD11 ' CD2' ' A' ' 117' ' ' HIS . 23.4 mm -67.63 -35.91 74.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.048 0 N-CA-C 113.801 1.037 . . . . 22.960000000000001 113.801 178.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 84.5 t -66.06 -47.65 84.23 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.756 0 N-CA-C 104.472 -2.418 . . . . 26.350000000000001 104.472 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.34 37.97 Favored 'General case' 0 N--CA 1.52 3.037 0 CA-C-O 122.961 1.362 . . . . 26.030000000000001 112.911 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . 0.536 HD11 ' HE2' ' B' ' 39' ' ' PHE . 3.1 tt -38.25 -53.95 1.43 Allowed 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.273 1.212 . . . . 39.520000000000003 114.273 168.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -65.48 -47.85 74.66 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.47 1.656 . . . . 28.920000000000002 115.47 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -69.9 -45.72 66.98 Favored 'General case' 0 C--O 1.192 -1.931 0 N-CA-C 108.142 -1.058 . . . . 38.899999999999999 108.142 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -61.62 -38.37 87.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.465 -0.788 . . . . 32.890000000000001 112.295 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.75 -37.5 65.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 118.257 0.48 . . . . 28.84 110.605 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.4 78.35 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 119.068 -1.053 . . . . 30.170000000000002 110.924 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -63.23 -43.29 98.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 123.571 0.545 . . . . 38.670000000000002 111.239 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -62.74 -31.8 72.81 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 122.867 1.318 . . . . 37.549999999999997 110.404 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.23 -37.74 75.07 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 119.942 -1.724 . . . . 43.859999999999999 112.377 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -98.07 5.56 48.56 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 116.113 1.894 . . . . 44.280000000000001 116.113 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.534 ' OE2' ' NH2' ' A' ' 87' ' ' ARG . 19.1 pt-20 -87.66 178.39 6.77 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.814 0.696 . . . . 45.829999999999998 111.213 -168.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . . . 25.39 -122.64 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 O-C-N 126.503 2.377 . . . . 54.770000000000003 111.364 147.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 115.932 -1.985 . . . . 71.209999999999994 112.887 179.905 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' HOH . . . . . 0.489 ' O ' ' HD2' ' A' ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1016 ' ' HOH . . . . . 0.474 ' O ' ' HA ' ' A' ' 121' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1002 ' ' HOH . . . . . 0.468 ' O ' ' HD3' ' B' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1007 ' ' HOH . . . . . 0.555 ' O ' ' HG3' ' B' ' 101' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1057 ' ' HOH . . . . . 0.409 ' O ' ' NH1' ' B' ' 57' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_