data_3hqa_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 3hqa _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 121.302 0.573 . . . . 89.420000000000002 111.54 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.6 155.41 37.89 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.98 -0.748 . . . . 100.25 108.98 168.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -65.69 -31.11 71.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.41 -0.516 . . . . 122.86 111.506 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -57.49 -38.08 73.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.462 -0.79 . . . . 81.439999999999998 109.952 175.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -81.57 -28.85 33.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.783 -0.644 . . . . 95.409999999999997 111.487 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mt -67.2 -43.13 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 116.071 -0.513 . . . . 53.240000000000002 110.119 176.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.42 -34.19 74.09 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.763 0.792 . . . . 86.230000000000004 109.368 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -58.47 -42.53 87.7 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.417 -1.265 . . . . 76.609999999999999 110.47 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.7 mt -69.94 -44.4 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 112.78 0.659 . . . . 50.119999999999997 112.78 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.91 -39.4 94.43 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.433 -0.58 . . . . 49.93 109.433 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.15 89.17 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.19 0.519 . . . . 48.439999999999998 110.354 -178.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -55.49 -29.57 59.04 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.665 -0.698 . . . . 76.909999999999997 112.454 -178.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -91.8 -15.28 28.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.535 1.68 . . . . 50.969999999999999 115.535 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -70.48 124.37 24.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.522 -0.308 . . . . 74.099999999999994 111.68 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 54.01 35.99 23.41 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.912 1.078 . . . . 48.219999999999999 113.912 175.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -34.84 72.41 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 112.589 0.588 . . . . 55.93 112.589 -174.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.28 -54.42 29.07 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 O-C-N 123.96 0.788 . . . . 50.090000000000003 111.064 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.7 t -52.26 -44.9 43.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 114.347 -1.297 . . . . 42.100000000000001 109.823 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.49 -56.17 24.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.852 1.797 . . . . 40.829999999999998 115.852 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -71.21 -38.13 72.03 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 119.037 -1.065 . . . . 89.120000000000005 112.604 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -75.71 -40.02 56.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 46.159999999999997 110.277 -171.757 -61.897 -123.953 -101.593 105.303 2.056 98.476 70.162 -179.591 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.9 t -58.38 -53.27 60.17 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 116.103 -0.499 . . . . 37.420000000000002 110.189 174.179 171.351 65.61 -83.932 103.309 2.013 115.849 -160.166 -75.308 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -51.8 -45.82 64.01 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.27 0.841 . . . . 51.909999999999997 113.27 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.12 -45.07 95.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 116.388 -0.369 . . . . 51.68 111.516 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.71 -34.62 89.23 Favored Glycine 0 N--CA 1.448 -0.545 0 O-C-N 123.878 0.736 . . . . 37.710000000000001 111.601 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -77.03 -19.47 57.16 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.762 1.393 . . . . 48.310000000000002 114.762 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 11.5 m -77.47 134.97 38.22 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.28 -0.968 . . . . 64.879999999999995 111.948 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.83 152.05 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 113.035 0.754 . . . . 86.799999999999997 113.035 -170.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -165.29 76.88 0.28 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.57 -2.011 . . . . 104.3 105.57 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -56.89 -25.55 57.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.898 0.703 . . . . 124.06999999999999 112.898 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -56.58 -37.57 70.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.294 -0.867 . . . . 108.39 111.137 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -129.19 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 116.549 2.055 . . . . 90.409999999999997 116.549 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 p -77.87 160.89 28.0 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.345 -0.843 . . . . 58.899999999999999 110.152 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 93.5 m -53.98 -45.92 71.53 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.105 -0.952 . . . . 44.759999999999998 111.765 179.461 -66.315 -62.984 -82.002 108.728 2.04 100.267 -90.124 -170.156 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -60.1 -42.92 95.7 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.441 -0.79 . . . . 68.469999999999999 112.818 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -61.08 -45.51 94.43 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.72 1.146 . . . . 81.019999999999996 111.204 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -67.01 -41.67 86.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.528 -0.469 . . . . 65.120000000000005 109.92 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.82 -33.25 74.82 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.702 0.63 . . . . 47.329999999999998 112.702 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.32 -37.8 70.44 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 54.310000000000002 111.046 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -76.78 -16.2 59.53 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.799 1.407 . . . . 110.88 114.799 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 19.9 mt -61.75 132.03 27.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.852 0.834 . . . . 55.409999999999997 112.307 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.1 p -113.09 4.93 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.959 -1.019 . . . . 72.200000000000003 112.523 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -83.31 -177.99 6.93 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.249 -1.019 . . . . 56.689999999999998 108.249 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.48 -179.32 30.96 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 117.446 1.739 . . . . 50.619999999999997 117.446 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -58.49 -43.83 42.48 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 124.348 3.366 . . . . 54.920000000000002 112.523 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -51.75 -43.83 63.09 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.469 -0.937 . . . . 104.63 108.469 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.8 t -65.78 -45.84 80.96 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.837 0.681 . . . . 43.159999999999997 112.837 -177.793 -179.591 70.162 -101.593 98.476 2.056 105.303 -123.953 -61.897 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.0 -44.64 99.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 115.622 -0.717 . . . . 46.640000000000001 111.704 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -63.42 -47.61 81.21 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.888 0.699 . . . . 66.939999999999998 112.888 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.76 -42.24 99.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.005 0.431 . . . . 36.640000000000001 111.494 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -60.48 -43.28 97.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.603 -0.518 . . . . 39.560000000000002 109.603 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.4 m -73.06 -51.19 19.05 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 115.374 -0.83 . . . . 37.350000000000001 109.862 -171.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -53.66 -49.84 67.07 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 124.084 0.865 . . . . 45.789999999999999 110.186 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 56.0 m -65.39 -40.68 93.78 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.703 1.371 . . . . 32.579999999999998 114.703 -176.478 -75.308 -160.166 -83.932 115.849 2.013 103.309 65.61 171.351 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.8 t -58.79 -49.51 77.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 39.649999999999999 112.609 172.375 -170.156 -90.124 -82.002 100.267 2.04 108.728 -62.984 -66.315 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 36.2 t -63.61 -49.28 83.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 120.495 -0.482 . . . . 35.890000000000001 111.902 -177.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.6 t -64.06 -42.1 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 112.172 0.434 . . . . 34.890000000000001 112.172 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.44 80.9 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 120.611 -0.435 . . . . 41.740000000000002 110.698 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.8 m -64.78 -43.44 93.21 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 113.866 1.061 . . . . 44.729999999999997 113.866 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -49.15 75.59 Favored 'General case' 0 C--O 1.223 -0.297 0 O-C-N 123.198 0.311 . . . . 68.939999999999998 111.298 172.151 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.7 mt -50.9 -51.92 47.05 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.875 0.369 . . . . 51.25 111.427 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.6 mtm-85 -65.87 -25.32 67.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.509 -0.769 . . . . 58.659999999999997 112.749 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.98 -43.16 30.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 69.349999999999994 111.33 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -58.99 -14.4 9.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.208 0.528 . . . . 75.310000000000002 112.224 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.4 mt -90.99 30.5 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-O 121.71 0.767 . . . . 82.180000000000007 110.56 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.531 0.24 0 CA-C-N 115.932 -0.576 . . . . 98.129999999999995 110.298 178.954 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 . . . . . 0 C--O 1.233 0.207 0 N-CA-C 111.662 0.245 . . . . 116.26000000000001 111.662 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -88.21 -45.48 10.05 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.285 0.564 . . . . 108.87 112.177 -174.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -75.07 -30.85 61.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.41 -0.814 . . . . 88.170000000000002 109.31 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 6.0 mt -57.31 -44.02 83.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 81.640000000000001 110.273 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -63.88 -35.18 79.81 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.284 -0.566 . . . . 127.13 109.888 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.29 -33.02 71.75 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.232 0.827 . . . . 102.73 113.232 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 48.7 mt -73.42 -34.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.071 -1.085 . . . . 64.549999999999997 108.071 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.8 99.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 59.200000000000003 109.925 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.33 -50.71 66.76 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.295 1.22 . . . . 53.579999999999998 114.295 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -59.52 -33.15 71.0 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.489 0.661 . . . . 100.01000000000001 110.859 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -70.6 -53.49 15.74 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.792 -0.64 . . . . 86.890000000000001 109.557 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -53.15 -45.13 68.3 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.625 -0.716 . . . . 83.640000000000001 110.413 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 22.7 t60 -63.74 -33.27 75.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.784 0.802 . . . . 76.900000000000006 111.603 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 32.1 t -66.55 -42.68 86.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.5 -0.773 . . . . 54.490000000000002 110.348 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.06 -51.23 74.96 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 114.665 -1.152 . . . . 52.850000000000001 110.825 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.1 t -57.58 -41.28 78.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.188 -0.915 . . . . 43.369999999999997 110.954 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -61.55 -47.44 85.53 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.991 -0.55 . . . . 103.81999999999999 109.87 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -61.9 -41.76 98.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.35 0.5 . . . . 90.209999999999994 112.35 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 84.8 m -71.84 -41.18 68.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.836 0.351 . . . . 40.219999999999999 110.985 -174.02 -59.746 -125.652 -99.967 110.764 2.03 99.905 60.114 -177.691 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -58.79 -53.61 56.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.137 -0.483 . . . . 39.0 110.803 174.664 173.419 72.931 -81.2 112.464 2.007 107.078 -170.482 -74.112 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -49.75 -47.24 50.93 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.775 -0.648 . . . . 57.630000000000003 112.735 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -62.31 -43.78 98.03 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 111.657 0.243 . . . . 52.039999999999999 111.657 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.34 -36.58 92.7 Favored Glycine 0 C--O 1.22 -0.746 0 N-CA-C 111.75 -0.54 . . . . 39.450000000000003 111.75 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.92 -18.12 59.49 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.849 1.425 . . . . 50.840000000000003 114.849 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 m -78.04 133.98 37.85 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.754 0.706 . . . . 70.590000000000003 112.745 177.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 t -59.25 150.56 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 113.226 0.824 . . . . 91.980000000000004 113.226 -169.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -163.77 77.99 0.4 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 106.031 -1.84 . . . . 100.52 106.031 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -58.67 -24.83 62.03 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.549 0.69 . . . . 121.26000000000001 111.943 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -56.59 -38.46 72.05 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.776 -1.102 . . . . 103.44 111.259 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -128.52 148.48 50.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 116.904 2.187 . . . . 86.629999999999995 116.904 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' THR . . . . . . . . . . . . . 54.4 p -76.51 161.12 28.88 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.401 -0.818 . . . . 57.200000000000003 110.988 173.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 97.7 m -58.03 -48.36 80.31 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-N 115.718 -0.674 . . . . 45.729999999999997 110.215 179.797 -69.659 -68.314 -90.902 97.061 2.017 109.438 -73.446 -171.785 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -52.61 -42.14 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 124.953 1.408 . . . . 74.659999999999997 112.35 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -69.88 -44.97 68.68 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 119.356 -0.938 . . . . 75.930000000000007 112.679 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -64.69 -43.19 94.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 119.8 -0.76 . . . . 68.069999999999993 111.32 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.3 -35.46 79.11 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 121.297 0.57 . . . . 47.539999999999999 112.301 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.54 -36.81 62.22 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.311 -0.858 . . . . 48.780000000000001 111.971 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -78.6 -14.35 59.36 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 114.35 1.241 . . . . 109.16 114.35 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 22.2 mt -61.77 131.06 26.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.134 0.968 . . . . 50.810000000000002 112.977 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -112.87 6.05 17.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.518 -0.765 . . . . 72.290000000000006 112.268 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 mt -83.34 -176.45 6.32 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.071 -0.714 . . . . 49.350000000000001 109.071 170.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -76.37 175.36 52.95 Favored Glycine 0 C--O 1.219 -0.784 0 N-CA-C 115.814 1.086 . . . . 44.329999999999998 115.814 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -40.24 81.48 Favored 'Trans proline' 0 CA--C 1.512 -0.617 0 C-N-CA 124.246 3.297 . . . . 52.939999999999998 111.55 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -53.74 -56.68 15.28 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 124.115 0.884 . . . . 93.969999999999999 111.614 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 49.4 t -56.99 -46.98 81.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.007 -0.542 . . . . 39.159999999999997 112.22 173.148 -177.691 60.114 -99.967 99.905 2.03 110.764 -125.652 -59.746 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 95.8 mt -57.01 -48.65 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 123.912 0.885 . . . . 41.689999999999998 112.877 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.64 -45.22 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.172 0.434 . . . . 54.039999999999999 112.172 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.39 -43.32 91.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.114 0.483 . . . . 35.380000000000003 110.77 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -58.21 -43.48 87.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 40.049999999999997 110.384 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -70.77 -51.36 27.53 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 115.498 -0.774 . . . . 32.890000000000001 110.996 -173.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -54.17 -45.15 72.0 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.692 0.62 . . . . 35.270000000000003 110.593 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.16 -41.18 64.18 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.466 1.654 . . . . 33.780000000000001 115.466 -176.21 -74.112 -170.482 -81.2 107.078 2.007 112.464 72.931 173.419 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.25 -46.82 87.48 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.238 -0.892 . . . . 34.310000000000002 111.538 175.241 -171.785 -73.446 -90.902 109.438 2.017 97.061 -68.314 -69.659 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 t -64.92 -46.68 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 119.965 -0.694 . . . . 37.539999999999999 111.373 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -66.92 -41.79 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.962 -0.563 . . . . 37.390000000000001 112.337 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.17 82.98 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.668 0.27 . . . . 42.310000000000002 111.196 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 26.1 m -65.11 -46.2 82.01 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 115.072 1.508 . . . . 45.520000000000003 115.072 175.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.21 -32.71 70.19 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.034 -1.067 . . . . 71.670000000000002 109.716 177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 32.9 mt -67.39 -52.73 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.235 0.457 . . . . 53.289999999999999 112.235 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 49.2 mtm-85 -65.72 -23.47 66.76 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.759 -0.655 . . . . 62.509999999999998 112.089 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.74 -43.16 23.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.725 -0.67 . . . . 68.359999999999999 109.854 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -59.87 -14.99 17.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.497 0.665 . . . . 77.170000000000002 111.269 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' B' ' 65' ' ' ILE . 36.3 mt -89.32 30.07 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.552 0.691 . . . . 81.900000000000006 110.867 178.361 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.083 -0.508 . . . . 94.930000000000007 110.368 179.689 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 121.302 0.573 . . . . 89.42 111.54 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.6 155.41 37.89 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.98 -0.748 . . . . 100.25 108.98 168.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -65.69 -31.11 71.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.41 -0.516 . . . . 122.86 111.506 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -57.49 -38.08 73.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.462 -0.79 . . . . 81.44 109.952 175.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -81.57 -28.85 33.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.783 -0.644 . . . . 95.41 111.487 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mt -67.2 -43.13 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 116.071 -0.513 . . . . 53.24 110.119 176.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.42 -34.19 74.09 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.763 0.792 . . . . 86.23 109.368 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -58.47 -42.53 87.7 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.417 -1.265 . . . . 76.61 110.47 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.7 mt -69.94 -44.4 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 112.78 0.659 . . . . 50.12 112.78 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.91 -39.4 94.43 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.433 -0.58 . . . . 49.93 109.433 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.15 89.17 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.19 0.519 . . . . 48.44 110.354 -178.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -55.49 -29.57 59.04 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.665 -0.698 . . . . 76.91 112.454 -178.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -91.8 -15.28 28.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.535 1.68 . . . . 50.97 115.535 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -70.48 124.37 24.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.522 -0.308 . . . . 74.1 111.68 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 54.01 35.99 23.41 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.912 1.078 . . . . 48.22 113.912 175.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -34.84 72.41 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 112.589 0.588 . . . . 55.93 112.589 -174.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.28 -54.42 29.07 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 O-C-N 123.96 0.788 . . . . 50.09 111.064 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.7 t -52.26 -44.9 43.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 114.347 -1.297 . . . . 42.1 109.823 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.49 -56.17 24.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.852 1.797 . . . . 40.83 115.852 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -71.21 -38.13 72.03 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 119.037 -1.065 . . . . 89.12 112.604 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -75.71 -40.02 56.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 46.16 110.277 -171.757 -61.897 -123.953 -101.593 105.303 2.056 98.476 70.162 -179.591 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.9 t -58.38 -53.27 60.17 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 116.103 -0.499 . . . . 37.42 110.189 174.179 171.351 65.61 -83.932 103.309 2.013 115.849 -160.166 -75.308 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -51.8 -45.82 64.01 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.27 0.841 . . . . 51.91 113.27 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.12 -45.07 95.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 116.388 -0.369 . . . . 51.68 111.516 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.71 -34.62 89.23 Favored Glycine 0 N--CA 1.448 -0.545 0 O-C-N 123.878 0.736 . . . . 37.71 111.601 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -77.03 -19.47 57.16 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.762 1.393 . . . . 48.31 114.762 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 11.5 m -77.47 134.97 38.22 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.28 -0.968 . . . . 64.88 111.948 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' OE1' ' B' ' 60' ' ' GLN . 16.7 t -58.83 152.05 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 113.035 0.754 . . . . 86.8 113.035 -170.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . 0.44 ' N ' HG12 ' A' ' 28' ' ' VAL . 36.6 t-20 -165.29 76.88 0.28 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.57 -2.011 . . . . 104.3 105.57 173.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -56.89 -25.55 57.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.898 0.703 . . . . 124.07 112.898 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -56.58 -37.57 70.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.294 -0.867 . . . . 108.39 111.137 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -129.19 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 116.549 2.055 . . . . 90.41 116.549 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 p -77.87 160.89 28.0 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.345 -0.843 . . . . 58.9 110.152 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 93.5 m -53.98 -45.92 71.53 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.105 -0.952 . . . . 44.76 111.765 179.461 -66.315 -62.984 -82.002 108.728 2.04 100.267 -90.124 -170.156 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -60.1 -42.92 95.7 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.441 -0.79 . . . . 68.47 112.818 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -61.08 -45.51 94.43 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.72 1.146 . . . . 81.02 111.204 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -67.01 -41.67 86.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.528 -0.469 . . . . 65.12 109.92 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 41' ' ' ILE . . . -62.82 -33.25 74.82 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.702 0.63 . . . . 47.33 112.702 -177.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.32 -37.8 70.44 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 54.31 111.046 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -76.78 -16.2 59.53 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.799 1.407 . . . . 110.88 114.799 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 38' ' ' ALA . 19.9 mt -61.75 132.03 27.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.852 0.834 . . . . 55.41 112.307 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.1 p -113.09 4.93 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.959 -1.019 . . . . 72.2 112.523 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -83.31 -177.99 6.93 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.249 -1.019 . . . . 56.69 108.249 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.48 -179.32 30.96 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 117.446 1.739 . . . . 50.62 117.446 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -58.49 -43.83 42.48 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 124.348 3.366 . . . . 54.92 112.523 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -51.75 -43.83 63.09 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.469 -0.937 . . . . 104.63 108.469 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.8 t -65.78 -45.84 80.96 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.837 0.681 . . . . 43.16 112.837 -177.793 -179.591 70.162 -101.593 98.476 2.056 105.303 -123.953 -61.897 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.0 -44.64 99.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 115.622 -0.717 . . . . 46.64 111.704 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -63.42 -47.61 81.21 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.888 0.699 . . . . 66.94 112.888 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.76 -42.24 99.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.005 0.431 . . . . 36.64 111.494 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -60.48 -43.28 97.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.603 -0.518 . . . . 39.56 109.603 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.4 m -73.06 -51.19 19.05 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 115.374 -0.83 . . . . 37.35 109.862 -171.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -53.66 -49.84 67.07 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 124.084 0.865 . . . . 45.79 110.186 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 56.0 m -65.39 -40.68 93.78 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.703 1.371 . . . . 32.58 114.703 -176.478 -75.308 -160.166 -83.932 115.849 2.013 103.309 65.61 171.351 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.8 t -58.79 -49.51 77.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 39.65 112.609 172.375 -170.156 -90.124 -82.002 100.267 2.04 108.728 -62.984 -66.315 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 36.2 t -63.61 -49.28 83.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 120.495 -0.482 . . . . 35.89 111.902 -177.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.6 t -64.06 -42.1 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 112.172 0.434 . . . . 34.89 112.172 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.44 80.9 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 120.611 -0.435 . . . . 41.74 110.698 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.8 m -64.78 -43.44 93.21 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 113.866 1.061 . . . . 44.73 113.866 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -56.51 -49.15 75.59 Favored 'General case' 0 C--O 1.223 -0.297 0 O-C-N 123.198 0.311 . . . . 68.94 111.298 172.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' HG13 ' A' ' 65' ' ' ILE . 26.7 mt -50.9 -51.92 47.05 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.875 0.369 . . . . 51.25 111.427 178.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.6 mtm-85 -65.87 -25.32 67.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.509 -0.769 . . . . 58.66 112.749 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.98 -43.16 30.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 69.35 111.33 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -58.99 -14.4 9.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.208 0.528 . . . . 75.31 112.224 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . 0.61 HG22 ' O ' ' A' ' 65' ' ' ILE . 37.4 mt -90.99 30.5 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-O 121.71 0.767 . . . . 82.18 110.56 178.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.531 0.24 0 CA-C-N 115.932 -0.576 . . . . 98.13 110.298 178.954 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 . . . . . 0 C--O 1.233 0.207 0 N-CA-C 111.662 0.245 . . . . 116.26 111.662 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -88.21 -45.48 10.05 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.285 0.564 . . . . 108.87 112.177 -174.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -75.07 -30.85 61.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.41 -0.814 . . . . 88.17 109.31 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 6.0 mt -57.31 -44.02 83.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 81.64 110.273 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -63.88 -35.18 79.81 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.284 -0.566 . . . . 127.13 109.888 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.29 -33.02 71.75 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.232 0.827 . . . . 102.73 113.232 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 48.7 mt -73.42 -34.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.071 -1.085 . . . . 64.55 108.071 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.8 99.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 59.2 109.925 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.33 -50.71 66.76 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.295 1.22 . . . . 53.58 114.295 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -59.52 -33.15 71.0 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.489 0.661 . . . . 100.01 110.859 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -70.6 -53.49 15.74 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.792 -0.64 . . . . 86.89 109.557 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -53.15 -45.13 68.3 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.625 -0.716 . . . . 83.64 110.413 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 22.7 t60 -63.74 -33.27 75.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.784 0.802 . . . . 76.9 111.603 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 32.1 t -66.55 -42.68 86.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.5 -0.773 . . . . 54.49 110.348 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.06 -51.23 74.96 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 114.665 -1.152 . . . . 52.85 110.825 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.1 t -57.58 -41.28 78.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.188 -0.915 . . . . 43.37 110.954 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -61.55 -47.44 85.53 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.991 -0.55 . . . . 103.82 109.87 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -61.9 -41.76 98.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.35 0.5 . . . . 90.21 112.35 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 84.8 m -71.84 -41.18 68.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.836 0.351 . . . . 40.22 110.985 -174.02 -59.746 -125.652 -99.967 110.764 2.03 99.905 60.114 -177.691 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -58.79 -53.61 56.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.137 -0.483 . . . . 39.0 110.803 174.664 173.419 72.931 -81.2 112.464 2.007 107.078 -170.482 -74.112 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -49.75 -47.24 50.93 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.775 -0.648 . . . . 57.63 112.735 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -62.31 -43.78 98.03 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 111.657 0.243 . . . . 52.04 111.657 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.34 -36.58 92.7 Favored Glycine 0 C--O 1.22 -0.746 0 N-CA-C 111.75 -0.54 . . . . 39.45 111.75 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.92 -18.12 59.49 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.849 1.425 . . . . 50.84 114.849 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 m -78.04 133.98 37.85 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.754 0.706 . . . . 70.59 112.745 177.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . 0.434 HG12 ' N ' ' B' ' 29' ' ' ASN . 15.5 t -59.25 150.56 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 113.226 0.824 . . . . 91.98 113.226 -169.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASN . . . . . 0.434 ' N ' HG12 ' B' ' 28' ' ' VAL . 36.1 t-20 -163.77 77.99 0.4 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 106.031 -1.84 . . . . 100.52 106.031 173.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -58.67 -24.83 62.03 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.549 0.69 . . . . 121.26 111.943 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -56.59 -38.46 72.05 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.776 -1.102 . . . . 103.44 111.259 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -128.52 148.48 50.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 116.904 2.187 . . . . 86.63 116.904 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' THR . . . . . . . . . . . . . 54.4 p -76.51 161.12 28.88 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.401 -0.818 . . . . 57.2 110.988 173.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 97.7 m -58.03 -48.36 80.31 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-N 115.718 -0.674 . . . . 45.73 110.215 179.797 -69.659 -68.314 -90.902 97.061 2.017 109.438 -73.446 -171.785 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -52.61 -42.14 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 124.953 1.408 . . . . 74.66 112.35 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -69.88 -44.97 68.68 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 119.356 -0.938 . . . . 75.93 112.679 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -64.69 -43.19 94.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 119.8 -0.76 . . . . 68.07 111.32 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . 0.651 ' HA ' HD12 ' B' ' 41' ' ' ILE . . . -62.3 -35.46 79.11 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 121.297 0.57 . . . . 47.54 112.301 -177.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.54 -36.81 62.22 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.311 -0.858 . . . . 48.78 111.971 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -78.6 -14.35 59.36 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 114.35 1.241 . . . . 109.16 114.35 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' B' ' 38' ' ' ALA . 22.2 mt -61.77 131.06 26.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.134 0.968 . . . . 50.81 112.977 -179.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -112.87 6.05 17.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.518 -0.765 . . . . 72.29 112.268 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 mt -83.34 -176.45 6.32 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.071 -0.714 . . . . 49.35 109.071 170.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -76.37 175.36 52.95 Favored Glycine 0 C--O 1.219 -0.784 0 N-CA-C 115.814 1.086 . . . . 44.33 115.814 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -40.24 81.48 Favored 'Trans proline' 0 CA--C 1.512 -0.617 0 C-N-CA 124.246 3.297 . . . . 52.94 111.55 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -53.74 -56.68 15.28 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 124.115 0.884 . . . . 93.97 111.614 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 49.4 t -56.99 -46.98 81.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.007 -0.542 . . . . 39.16 112.22 173.148 -177.691 60.114 -99.967 99.905 2.03 110.764 -125.652 -59.746 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 95.8 mt -57.01 -48.65 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 123.912 0.885 . . . . 41.69 112.877 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.64 -45.22 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.172 0.434 . . . . 54.04 112.172 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.39 -43.32 91.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.114 0.483 . . . . 35.38 110.77 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -58.21 -43.48 87.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 40.05 110.384 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -70.77 -51.36 27.53 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 115.498 -0.774 . . . . 32.89 110.996 -173.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -54.17 -45.15 72.0 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.692 0.62 . . . . 35.27 110.593 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.16 -41.18 64.18 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.466 1.654 . . . . 33.78 115.466 -176.21 -74.112 -170.482 -81.2 107.078 2.007 112.464 72.931 173.419 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.25 -46.82 87.48 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.238 -0.892 . . . . 34.31 111.538 175.241 -171.785 -73.446 -90.902 109.438 2.017 97.061 -68.314 -69.659 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 t -64.92 -46.68 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 119.965 -0.694 . . . . 37.54 111.373 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -66.92 -41.79 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.962 -0.563 . . . . 37.39 112.337 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.17 82.98 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.668 0.27 . . . . 42.31 111.196 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 26.1 m -65.11 -46.2 82.01 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 115.072 1.508 . . . . 45.52 115.072 175.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . 0.522 ' OE1' HG23 ' A' ' 28' ' ' VAL . 24.4 mt-30 -59.21 -32.71 70.19 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.034 -1.067 . . . . 71.67 109.716 177.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 65' ' ' ILE . 32.9 mt -67.39 -52.73 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.235 0.457 . . . . 53.29 112.235 179.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 49.2 mtm-85 -65.72 -23.47 66.76 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.759 -0.655 . . . . 62.51 112.089 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.74 -43.16 23.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.725 -0.67 . . . . 68.36 109.854 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -59.87 -14.99 17.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.497 0.665 . . . . 77.17 111.269 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ILE . . . . . 0.65 ' O ' HG22 ' B' ' 65' ' ' ILE . 36.3 mt -89.32 30.07 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.552 0.691 . . . . 81.9 110.867 178.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.083 -0.508 . . . . 94.93 110.368 179.689 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 121.302 0.573 . . . . 89.42 111.54 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.6 155.41 37.89 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.98 -0.748 . . . . 100.25 108.98 168.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -65.69 -31.11 71.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.41 -0.516 . . . . 122.86 111.506 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ttmt -57.49 -38.08 73.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.462 -0.79 . . . . 81.44 109.952 175.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -81.57 -28.85 33.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.783 -0.644 . . . . 95.41 111.487 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mt -67.2 -43.13 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 116.071 -0.513 . . . . 53.24 110.119 176.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.42 -34.19 74.09 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.763 0.792 . . . . 86.23 109.368 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -58.47 -42.53 87.7 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.417 -1.265 . . . . 76.61 110.47 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.7 mt -69.94 -44.4 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 112.78 0.659 . . . . 50.12 112.78 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.91 -39.4 94.43 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.433 -0.58 . . . . 49.93 109.433 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.15 89.17 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.19 0.519 . . . . 48.44 110.354 -178.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -55.49 -29.57 59.04 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.665 -0.698 . . . . 76.91 112.454 -178.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -91.8 -15.28 28.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.535 1.68 . . . . 50.97 115.535 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -70.48 124.37 24.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.522 -0.308 . . . . 74.1 111.68 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 54.01 35.99 23.41 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 113.912 1.078 . . . . 48.22 113.912 175.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -34.84 72.41 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 112.589 0.588 . . . . 55.93 112.589 -174.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.28 -54.42 29.07 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 O-C-N 123.96 0.788 . . . . 50.09 111.064 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.7 t -52.26 -44.9 43.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 114.347 -1.297 . . . . 42.1 109.823 173.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.49 -56.17 24.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.852 1.797 . . . . 40.83 115.852 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -71.21 -38.13 72.03 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 119.037 -1.065 . . . . 89.12 112.604 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -75.71 -40.02 56.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 46.16 110.277 -171.757 -61.897 -123.953 -101.593 105.303 2.056 98.476 70.162 -179.591 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.9 t -58.38 -53.27 60.17 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 116.103 -0.499 . . . . 37.42 110.189 174.179 171.351 65.61 -83.932 103.309 2.013 115.849 -160.166 -75.308 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -51.8 -45.82 64.01 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.27 0.841 . . . . 51.91 113.27 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.12 -45.07 95.09 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 116.388 -0.369 . . . . 51.68 111.516 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.71 -34.62 89.23 Favored Glycine 0 N--CA 1.448 -0.545 0 O-C-N 123.878 0.736 . . . . 37.71 111.601 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -77.03 -19.47 57.16 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.762 1.393 . . . . 48.31 114.762 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 11.5 m -77.47 134.97 38.22 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.28 -0.968 . . . . 64.88 111.948 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.723 HG23 HE22 ' B' ' 60' ' ' GLN . 16.7 t -58.83 152.05 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 113.035 0.754 . . . . 86.8 113.035 -170.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.44 ' N ' HG12 ' A' ' 28' ' ' VAL . 36.6 t-20 -165.29 76.88 0.28 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.57 -2.011 . . . . 104.3 105.57 173.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -56.89 -25.55 57.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.898 0.703 . . . . 124.07 112.898 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -56.58 -37.57 70.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.294 -0.867 . . . . 108.39 111.137 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -129.19 149.61 50.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 116.549 2.055 . . . . 90.41 116.549 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 p -77.87 160.89 28.0 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.345 -0.843 . . . . 58.9 110.152 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 93.5 m -53.98 -45.92 71.53 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.105 -0.952 . . . . 44.76 111.765 179.461 -66.315 -62.984 -82.002 108.728 2.04 100.267 -90.124 -170.156 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -60.1 -42.92 95.7 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.441 -0.79 . . . . 68.47 112.818 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -61.08 -45.51 94.43 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.72 1.146 . . . . 81.02 111.204 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -67.01 -41.67 86.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.528 -0.469 . . . . 65.12 109.92 -178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 41' ' ' ILE . . . -62.82 -33.25 74.82 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.702 0.63 . . . . 47.33 112.702 -177.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.32 -37.8 70.44 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.832 -0.622 . . . . 54.31 111.046 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -76.78 -16.2 59.53 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.799 1.407 . . . . 110.88 114.799 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 38' ' ' ALA . 19.9 mt -61.75 132.03 27.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.852 0.834 . . . . 55.41 112.307 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.1 p -113.09 4.93 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.959 -1.019 . . . . 72.2 112.523 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -83.31 -177.99 6.93 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.249 -1.019 . . . . 56.69 108.249 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.48 -179.32 30.96 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 117.446 1.739 . . . . 50.62 117.446 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -58.49 -43.83 42.48 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 124.348 3.366 . . . . 54.92 112.523 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.3 mtp180 -51.75 -43.83 63.09 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.469 -0.937 . . . . 104.63 108.469 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.8 t -65.78 -45.84 80.96 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 112.837 0.681 . . . . 43.16 112.837 -177.793 -179.591 70.162 -101.593 98.476 2.056 105.303 -123.953 -61.897 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.0 -44.64 99.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 CA-C-N 115.622 -0.717 . . . . 46.64 111.704 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -63.42 -47.61 81.21 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.888 0.699 . . . . 66.94 112.888 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.76 -42.24 99.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.005 0.431 . . . . 36.64 111.494 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -60.48 -43.28 97.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.603 -0.518 . . . . 39.56 109.603 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.4 m -73.06 -51.19 19.05 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 115.374 -0.83 . . . . 37.35 109.862 -171.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -53.66 -49.84 67.07 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 124.084 0.865 . . . . 45.79 110.186 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 56.0 m -65.39 -40.68 93.78 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.703 1.371 . . . . 32.58 114.703 -176.478 -75.308 -160.166 -83.932 115.849 2.013 103.309 65.61 171.351 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.8 t -58.79 -49.51 77.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 39.65 112.609 172.375 -170.156 -90.124 -82.002 100.267 2.04 108.728 -62.984 -66.315 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 36.2 t -63.61 -49.28 83.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 120.495 -0.482 . . . . 35.89 111.902 -177.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.6 t -64.06 -42.1 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 112.172 0.434 . . . . 34.89 112.172 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.44 80.9 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 120.611 -0.435 . . . . 41.74 110.698 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.8 m -64.78 -43.44 93.21 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 113.866 1.061 . . . . 44.73 113.866 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -49.15 75.59 Favored 'General case' 0 C--O 1.223 -0.297 0 O-C-N 123.198 0.311 . . . . 68.94 111.298 172.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' HG13 ' A' ' 65' ' ' ILE . 26.7 mt -50.9 -51.92 47.05 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.875 0.369 . . . . 51.25 111.427 178.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.6 mtm-85 -65.87 -25.32 67.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.509 -0.769 . . . . 58.66 112.749 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.98 -43.16 30.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 69.35 111.33 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -58.99 -14.4 9.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.208 0.528 . . . . 75.31 112.224 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.61 HG22 ' O ' ' A' ' 65' ' ' ILE . 37.4 mt -90.99 30.5 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-O 121.71 0.767 . . . . 82.18 110.56 178.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.531 0.24 0 CA-C-N 115.932 -0.576 . . . . 98.13 110.298 178.954 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 . . . . . 0 C--O 1.233 0.207 0 N-CA-C 111.662 0.245 . . . . 116.26 111.662 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -88.21 -45.48 10.05 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.285 0.564 . . . . 108.87 112.177 -174.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -75.07 -30.85 61.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.41 -0.814 . . . . 88.17 109.31 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 6.0 mt -57.31 -44.02 83.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 81.64 110.273 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -63.88 -35.18 79.81 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.284 -0.566 . . . . 127.13 109.888 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.29 -33.02 71.75 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.232 0.827 . . . . 102.73 113.232 173.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 48.7 mt -73.42 -34.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.071 -1.085 . . . . 64.55 108.071 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -42.8 99.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 59.2 109.925 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.33 -50.71 66.76 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.295 1.22 . . . . 53.58 114.295 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 56.0 mttt -59.52 -33.15 71.0 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.489 0.661 . . . . 100.01 110.859 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -70.6 -53.49 15.74 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.792 -0.64 . . . . 86.89 109.557 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -53.15 -45.13 68.3 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.625 -0.716 . . . . 83.64 110.413 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 22.7 t60 -63.74 -33.27 75.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.784 0.802 . . . . 76.9 111.603 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 32.1 t -66.55 -42.68 86.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.5 -0.773 . . . . 54.49 110.348 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.06 -51.23 74.96 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 CA-C-N 114.665 -1.152 . . . . 52.85 110.825 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.1 t -57.58 -41.28 78.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.188 -0.915 . . . . 43.37 110.954 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -61.55 -47.44 85.53 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.991 -0.55 . . . . 103.82 109.87 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -61.9 -41.76 98.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.35 0.5 . . . . 90.21 112.35 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 84.8 m -71.84 -41.18 68.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.836 0.351 . . . . 40.22 110.985 -174.02 -59.746 -125.652 -99.967 110.764 2.03 99.905 60.114 -177.691 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -58.79 -53.61 56.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.137 -0.483 . . . . 39.0 110.803 174.664 173.419 72.931 -81.2 112.464 2.007 107.078 -170.482 -74.112 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -49.75 -47.24 50.93 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.775 -0.648 . . . . 57.63 112.735 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -62.31 -43.78 98.03 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 111.657 0.243 . . . . 52.04 111.657 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.34 -36.58 92.7 Favored Glycine 0 C--O 1.22 -0.746 0 N-CA-C 111.75 -0.54 . . . . 39.45 111.75 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.92 -18.12 59.49 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.849 1.425 . . . . 50.84 114.849 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 m -78.04 133.98 37.85 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.754 0.706 . . . . 70.59 112.745 177.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.434 HG12 ' N ' ' B' ' 29' ' ' ASN . 15.5 t -59.25 150.56 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 113.226 0.824 . . . . 91.98 113.226 -169.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASN . . . . . 0.434 ' N ' HG12 ' B' ' 28' ' ' VAL . 36.1 t-20 -163.77 77.99 0.4 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 106.031 -1.84 . . . . 100.52 106.031 173.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -58.67 -24.83 62.03 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.549 0.69 . . . . 121.26 111.943 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -56.59 -38.46 72.05 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.776 -1.102 . . . . 103.44 111.259 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -128.52 148.48 50.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 116.904 2.187 . . . . 86.63 116.904 -171.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' THR . . . . . . . . . . . . . 54.4 p -76.51 161.12 28.88 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.401 -0.818 . . . . 57.2 110.988 173.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 97.7 m -58.03 -48.36 80.31 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-N 115.718 -0.674 . . . . 45.73 110.215 179.797 -69.659 -68.314 -90.902 97.061 2.017 109.438 -73.446 -171.785 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -52.61 -42.14 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 O-C-N 124.953 1.408 . . . . 74.66 112.35 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -69.88 -44.97 68.68 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 119.356 -0.938 . . . . 75.93 112.679 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -64.69 -43.19 94.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 119.8 -0.76 . . . . 68.07 111.32 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . 0.651 ' HA ' HD12 ' B' ' 41' ' ' ILE . . . -62.3 -35.46 79.11 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 121.297 0.57 . . . . 47.54 112.301 -177.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.54 -36.81 62.22 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.311 -0.858 . . . . 48.78 111.971 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -78.6 -14.35 59.36 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 114.35 1.241 . . . . 109.16 114.35 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' B' ' 38' ' ' ALA . 22.2 mt -61.77 131.06 26.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.134 0.968 . . . . 50.81 112.977 -179.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -112.87 6.05 17.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.518 -0.765 . . . . 72.29 112.268 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 mt -83.34 -176.45 6.32 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.071 -0.714 . . . . 49.35 109.071 170.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -76.37 175.36 52.95 Favored Glycine 0 C--O 1.219 -0.784 0 N-CA-C 115.814 1.086 . . . . 44.33 115.814 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -40.24 81.48 Favored 'Trans proline' 0 CA--C 1.512 -0.617 0 C-N-CA 124.246 3.297 . . . . 52.94 111.55 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -53.74 -56.68 15.28 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 124.115 0.884 . . . . 93.97 111.614 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 49.4 t -56.99 -46.98 81.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.007 -0.542 . . . . 39.16 112.22 173.148 -177.691 60.114 -99.967 99.905 2.03 110.764 -125.652 -59.746 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 95.8 mt -57.01 -48.65 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 123.912 0.885 . . . . 41.69 112.877 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -63.64 -45.22 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.172 0.434 . . . . 54.04 112.172 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.39 -43.32 91.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.114 0.483 . . . . 35.38 110.77 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -58.21 -43.48 87.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 40.05 110.384 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -70.77 -51.36 27.53 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 115.498 -0.774 . . . . 32.89 110.996 -173.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -54.17 -45.15 72.0 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 123.692 0.62 . . . . 35.27 110.593 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.16 -41.18 64.18 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.466 1.654 . . . . 33.78 115.466 -176.21 -74.112 -170.482 -81.2 107.078 2.007 112.464 72.931 173.419 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.25 -46.82 87.48 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.238 -0.892 . . . . 34.31 111.538 175.241 -171.785 -73.446 -90.902 109.438 2.017 97.061 -68.314 -69.659 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 t -64.92 -46.68 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 119.965 -0.694 . . . . 37.54 111.373 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -66.92 -41.79 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 115.962 -0.563 . . . . 37.39 112.337 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.17 82.98 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.668 0.27 . . . . 42.31 111.196 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 26.1 m -65.11 -46.2 82.01 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 115.072 1.508 . . . . 45.52 115.072 175.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.723 HE22 HG23 ' A' ' 28' ' ' VAL . 83.4 mt-30 -59.21 -32.71 70.19 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.034 -1.067 . . . . 71.67 109.716 177.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 65' ' ' ILE . 32.9 mt -67.39 -52.73 36.31 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.235 0.457 . . . . 53.29 112.235 179.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 49.2 mtm-85 -65.72 -23.47 66.76 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.759 -0.655 . . . . 62.51 112.089 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.74 -43.16 23.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.725 -0.67 . . . . 68.36 109.854 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -59.87 -14.99 17.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.497 0.665 . . . . 77.17 111.269 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ILE . . . . . 0.65 ' O ' HG22 ' B' ' 65' ' ' ILE . 36.3 mt -89.32 30.07 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.552 0.691 . . . . 81.9 110.867 178.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.083 -0.508 . . . . 94.93 110.368 179.689 . . . . . . . . 0 0 . 1 stop_ save_