data_3ih2_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 3ih2 _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 ' 0' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 113.329 0.862 . . . . 73.590000000000003 113.329 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 28.7 mtt -112.21 175.24 5.51 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.062 -1.088 . . . . 68.269999999999996 108.062 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.43 150.29 31.45 Favored 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 108.852 -0.796 . . . . 57.140000000000001 108.852 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.2 p -61.47 160.09 11.67 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 107.553 -1.277 . . . . 51.770000000000003 107.553 167.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -60.98 -33.41 73.18 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.732 -0.787 . . . . 51.560000000000002 113.029 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 0.495 ' NH1' ' O ' ' A' ' 204' ' ' HOH . 54.0 ttt-85 -71.82 -41.22 68.46 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.6 0.714 . . . . 61.409999999999997 109.847 -176.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -70.58 -29.83 66.36 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 121.347 -0.845 . . . . 48.329999999999998 112.238 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.86 -42.66 85.28 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.467 -0.77 . . . . 40.530000000000001 110.897 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.41 -48.61 84.49 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.379 0 CA-C-N 114.069 -1.423 . . . . 42.299999999999997 114.769 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.64 -34.95 67.8 Favored 'General case' 0 C--O 1.2 -1.532 0 O-C-N 120.646 -1.284 . . . . 42.299999999999997 113.478 172.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.7 tttm -72.38 -48.36 42.22 Favored 'General case' 0 C--O 1.199 -1.56 0 O-C-N 121.127 -0.983 . . . . 43.630000000000003 112.538 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.89 -45.63 78.54 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 118.565 -0.731 . . . . 39.240000000000002 111.764 170.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.02 -55.24 37.33 Favored 'General case' 0 C--O 1.279 2.615 0 O-C-N 123.715 0.634 . . . . 39.909999999999997 112.638 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.0 t -46.8 -45.41 7.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 N-CA-C 113.337 0.866 . . . . 41.909999999999997 113.337 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -67.13 -45.99 75.46 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 115.874 1.805 . . . . 52.390000000000001 115.874 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -77.51 -39.46 27.45 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.42 0 CA-C-N 119.202 0.91 . . . . 44.729999999999997 112.0 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -60.98 -51.27 69.95 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 121.227 -0.921 . . . . 45.060000000000002 109.887 173.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.25 -35.2 69.61 Favored Glycine 0 C--O 1.219 -0.833 0 O-C-N 121.238 -0.914 . . . . 47.25 115.083 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -74.31 -43.15 57.93 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 115.087 1.514 . . . . 51.369999999999997 115.087 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -110.34 -20.17 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.418 1.636 . . . . 52.399999999999999 115.418 -170.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.91 174.45 47.98 Favored Glycine 0 C--O 1.214 -1.117 0 N-CA-C 109.137 -1.585 . . . . 48.130000000000003 109.137 -173.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -69.28 -43.75 73.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.409 0.892 . . . . 51.799999999999997 113.409 -169.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -72.31 -42.47 65.4 Favored 'General case' 0 C--O 1.218 -0.604 0 C-N-CA 123.216 0.606 . . . . 59.770000000000003 111.917 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -78.98 -30.44 44.38 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.437 0.903 . . . . 60.100000000000001 113.437 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . 0.432 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . . . -61.19 139.87 58.04 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.068 -1.086 . . . . 53.159999999999997 108.068 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.1 p -112.7 147.56 36.54 Favored 'General case' 0 N--CA 1.439 -1.014 0 O-C-N 124.221 0.951 . . . . 52.710000000000001 108.748 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 p -72.65 -25.98 61.48 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.955 -0.566 . . . . 52.469999999999999 112.157 177.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.16 -46.35 89.38 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 122.29 1.043 . . . . 62.609999999999999 108.777 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -65.46 -36.22 83.25 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.426 1.269 . . . . 58.75 114.426 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.61 -41.37 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.54 1.136 . . . . 48.579999999999998 111.452 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.22 96.2 Favored 'General case' 0 CA--C 1.503 -0.834 0 C-N-CA 122.591 0.356 . . . . 45.799999999999997 111.349 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -68.25 -37.02 80.32 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 120.379 -0.528 . . . . 44.359999999999999 110.228 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -67.09 -34.3 77.34 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.127 0.788 . . . . 52.009999999999998 113.127 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.54 -12.32 56.31 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 124.166 0.916 . . . . 44.399999999999999 112.752 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.15 46.23 58.92 Favored Glycine 0 C--N 1.339 0.746 0 N-CA-C 109.297 -1.521 . . . . 47.130000000000003 109.297 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 22.5 m -133.4 148.74 30.86 Favored 'Isoleucine or valine' 0 C--O 1.244 0.782 0 C-N-CA 124.417 1.087 . . . . 47.909999999999997 109.623 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.12 146.05 12.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.289 -0.634 . . . . 49.350000000000001 109.289 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -55.31 -47.65 75.29 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.911 0.862 . . . . 51.799999999999997 111.269 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -38.2 -40.21 0.84 Allowed Glycine 0 N--CA 1.48 1.582 0 N-CA-C 119.309 2.484 . . . . 52.57 119.309 165.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 20.7 mt -62.95 -24.03 67.68 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.38 2.363 . . . . 58.530000000000001 117.38 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.5 mt -71.53 -46.1 64.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.036 -1.098 . . . . 54.490000000000002 108.036 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -52.2 -49.02 64.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 119.538 -0.865 . . . . 49.780000000000001 110.379 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -53.63 -51.48 62.97 Favored 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 113.073 0.768 . . . . 48.780000000000001 113.073 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.12 -39.55 29.3 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 115.566 1.691 . . . . 52.240000000000002 115.566 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . 0.407 ' O ' ' CB ' ' A' ' 45' ' ' LYS . 93.5 m-85 -116.44 -3.3 11.9 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 119.67 3.211 . . . . 52.909999999999997 119.67 -172.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 44' ' ' PHE . . . 73.33 -63.12 0.45 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 122.355 2.343 . . . . 51.859999999999999 116.053 175.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 229' ' ' HOH . 10.1 p30 -149.13 -179.78 7.3 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.821 0.737 . . . . 52.240000000000002 111.355 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' NZ ' ' O ' ' A' ' 24' ' ' ALA . 26.9 ttpt -71.96 -34.24 68.82 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 123.502 0.501 . . . . 52.359999999999999 111.98 -179.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -62.16 -45.2 94.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.247 1.022 . . . . 55.799999999999997 112.42 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -64.83 -41.63 95.59 Favored 'General case' 0 CA--C 1.56 1.353 0 N-CA-C 115.071 1.508 . . . . 43.289999999999999 115.071 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.8 tp -57.26 -51.37 69.64 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 109.701 -0.481 . . . . 35.390000000000001 109.701 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -55.14 -46.57 75.69 Favored 'General case' 0 C--O 1.189 -2.109 0 N-CA-C 113.826 1.047 . . . . 32.32 113.826 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -64.41 -45.04 89.32 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 112.759 0.651 . . . . 35.609999999999999 112.759 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -66.13 -40.99 91.1 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 119.037 -0.506 . . . . 46.640000000000001 111.867 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.96 -37.31 86.58 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 113.576 0.954 . . . . 31.960000000000001 113.576 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.28 -44.4 79.38 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.872 -1.142 . . . . 36.189999999999998 112.471 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MSE . . . . . . . . . . . . . 21.3 mmt -60.7 -40.6 92.84 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 111.637 0.236 . . . . 59.439999999999998 111.637 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.2 t -65.24 -43.15 92.31 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 112.702 0.63 . . . . 37.130000000000003 112.702 -179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.98 -38.37 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.611 1.196 . . . . 33.079999999999998 111.036 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.7 t -74.03 -29.14 61.77 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 114.486 -1.234 . . . . 42.710000000000001 113.954 -176.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . . . -72.29 -26.58 62.03 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.261 0.624 . . . . 37.060000000000002 112.391 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -65.61 -46.54 78.95 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 109.962 -0.384 . . . . 49.409999999999997 109.962 168.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.52 -52.2 64.39 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 112.563 0.579 . . . . 38.520000000000003 112.563 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -48.96 -35.01 14.1 Favored 'General case' 0 C--O 1.204 -1.292 0 O-C-N 124.235 0.959 . . . . 45.630000000000003 111.38 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . . . -76.9 -44.49 31.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 119.109 -0.472 . . . . 41.299999999999997 112.175 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -47.77 -48.78 29.97 Favored 'General case' 0 C--O 1.205 -1.253 0 N-CA-C 108.758 -0.83 . . . . 45.119999999999997 108.758 165.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -61.95 -49.42 76.19 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 114.86 1.43 . . . . 38.280000000000001 114.86 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -59.1 -38.78 80.36 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 119.107 -0.473 . . . . 42.939999999999998 110.858 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -56.44 -49.45 74.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.46 0.647 . . . . 34.719999999999999 110.664 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -65.47 -45.86 82.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 119.402 -0.919 . . . . 29.879999999999999 111.98 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.22 -58.4 6.27 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 124.244 0.965 . . . . 33.369999999999997 110.827 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' MSE . . . . . . . . . . . . . 45.7 mtt -50.7 -34.38 26.51 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 124.241 0.963 . . . . 55.719999999999999 109.799 -168.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -88.85 -44.13 10.71 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 113.789 1.033 . . . . 38.289999999999999 113.789 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -95.37 4.35 53.46 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 115.952 1.834 . . . . 33.280000000000001 115.952 -175.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -33.97 -41.24 0.1 Allowed 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 117.51 2.411 . . . . 36.869999999999997 117.51 172.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -88.15 1.19 54.94 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.246 1.572 . . . . 38.469999999999999 115.246 -172.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . 0.609 ' O ' ' NZ ' ' A' ' 135' ' ' LYS . 51.3 mtt-85 -76.96 165.83 24.14 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 121.678 0.751 . . . . 37.740000000000002 109.855 -175.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.68 139.31 57.84 Favored 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 106.041 -1.837 . . . . 28.07 106.041 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.3 tp -62.85 -35.71 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 113.474 0.916 . . . . 27.739999999999998 113.474 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -66.74 -42.34 86.41 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.793 0.683 . . . . 23.440000000000001 111.102 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -61.6 -45.7 92.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.275 1.43 . . . . 30.149999999999999 111.687 172.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -55.0 -49.62 71.07 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.76 -1.564 . . . . 28.469999999999999 110.327 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 81.2 mtp -65.25 -51.08 63.12 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 117.982 2.586 . . . . 51.369999999999997 117.982 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -39.54 -55.9 1.74 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.632 -0.258 . . . . 30.43 110.647 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -75.19 -31.96 61.1 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 112.211 0.449 . . . . 40.270000000000003 112.211 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -68.72 -39.28 80.48 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 118.638 -1.225 . . . . 33.359999999999999 112.01 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.8 mt -65.31 -41.1 90.56 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.32 -0.863 . . . . 31.969999999999999 111.556 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -53.36 -50.04 65.88 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.227 0.611 . . . . 40.82 111.994 173.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -59.28 -39.76 83.96 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.331 -0.85 . . . . 36.259999999999998 112.943 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -66.88 -37.38 84.3 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.585 0.958 . . . . 45.950000000000003 113.585 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.22 -54.32 48.23 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.133 0.973 . . . . 31.68 110.944 173.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . . . -56.09 -44.14 78.73 Favored 'General case' 0 CA--C 1.558 1.263 0 CA-C-N 114.612 -1.177 . . . . 32.640000000000001 112.568 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -59.9 -47.4 85.93 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 119.93 1.241 . . . . 37.439999999999998 113.41 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -57.97 -37.9 75.06 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.844 1.424 . . . . 36.159999999999997 114.844 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.26 -34.77 71.03 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 123.033 0.533 . . . . 36.57 111.725 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 81.3 p -88.53 -16.71 31.94 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 123.919 0.762 . . . . 37.539999999999999 111.942 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -126.2 57.67 21.27 Favored Pre-proline 0 N--CA 1.494 1.739 0 N-CA-C 115.893 1.812 . . . . 34.299999999999997 115.893 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.11 -36.41 97.94 Favored 'Trans proline' 0 CA--C 1.551 1.373 0 N-CA-C 116.799 1.807 . . . . 31.609999999999999 116.799 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.0 mp0 -64.62 -45.71 85.72 Favored 'General case' 0 C--O 1.26 1.62 0 O-C-N 121.503 -0.748 . . . . 45.509999999999998 111.581 -179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -55.74 -42.75 75.82 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 115.231 1.567 . . . . 40.140000000000001 115.231 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.75 78.21 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.198 0.999 . . . . 29.850000000000001 112.393 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.64 -33.77 73.28 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.452 -0.899 . . . . 45.07 110.747 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -73.34 -42.94 61.68 Favored 'General case' 0 C--O 1.252 1.201 0 O-C-N 121.924 -0.485 . . . . 32.700000000000003 110.731 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.76 -34.58 71.58 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.437 1.113 . . . . 34.049999999999997 112.154 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . . . -75.79 -12.44 14.59 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.287 0 O-C-N 121.323 -0.861 . . . . 36.609999999999999 112.881 -174.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 38.3 p -74.03 -11.98 60.49 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.509 -0.744 . . . . 36.460000000000001 112.881 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -47.92 -35.31 10.39 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.791 1.281 . . . . 40.130000000000003 110.21 -178.234 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . 0.567 ' N ' ' O ' ' A' ' 216' ' ' HOH . 3.2 p -67.32 -29.33 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.826 0 N-CA-C 118.968 2.951 . . . . 45.579999999999998 118.968 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . . . -70.3 -18.51 63.11 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 116.81 2.152 . . . . 48.18 116.81 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 28.4 m -80.0 156.56 4.54 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 N-CA-C 113.42 0.896 . . . . 48.579999999999998 113.42 -169.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -56.9 141.64 44.25 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.163 0.431 . . . . 59.43 112.163 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -51.84 -34.64 41.43 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.324 -0.853 . . . . 50.899999999999999 111.45 -168.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.46 -6.82 89.08 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 117.502 1.761 . . . . 48.780000000000001 117.502 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 45.1 tp -97.22 -38.81 9.55 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 117.502 0.651 . . . . 46.469999999999999 109.308 165.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -64.69 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 117.907 -1.517 . . . . 57.609999999999999 110.261 178.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -62.81 -47.84 81.71 Favored 'General case' 0 C--O 1.209 -1.057 0 C-N-CA 123.701 0.8 . . . . 45.450000000000003 111.344 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -52.39 -50.32 62.7 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 124.294 0.996 . . . . 41.789999999999999 110.963 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.61 -42.01 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.601 0.593 . . . . 36.240000000000002 112.601 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.63 -39.7 70.22 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.265 0.469 . . . . 40.840000000000003 112.265 -174.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 85.1 mt -52.35 -52.09 55.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 124.013 0.925 . . . . 38.280000000000001 111.098 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -74.45 -22.05 59.3 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.466 -0.788 . . . . 42.850000000000001 110.842 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 46.9 mt -91.2 -16.66 27.31 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.101 0.778 . . . . 39.93 113.101 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -52.7 -40.1 62.62 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.937 0.717 . . . . 36.009999999999998 112.937 -170.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . . . -67.21 -39.56 86.32 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.795 -0.817 . . . . 38.060000000000002 108.795 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 p -81.47 -40.52 23.15 Favored 'General case' 0 CA--C 1.551 1.002 0 O-C-N 123.481 0.488 . . . . 38.409999999999997 110.338 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -60.52 -32.24 71.27 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.816 1.043 . . . . 44.399999999999999 113.816 169.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -63.44 -22.9 67.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 117.825 -1.083 . . . . 39.689999999999998 113.48 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.91 -51.61 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.634 0 CA-C-N 120.729 1.604 . . . . 34.530000000000001 112.843 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.9 -47.79 79.19 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 120.855 -1.153 . . . . 39.100000000000001 111.0 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -52.33 -49.15 64.84 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.016 -0.993 . . . . 33.329999999999998 111.825 177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.88 -20.92 66.0 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 113.933 1.086 . . . . 38.659999999999997 113.933 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -80.39 -44.59 19.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.724 -1.125 . . . . 32.310000000000002 109.254 -178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.35 -46.76 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.307 0 CA-C-N 115.112 -0.949 . . . . 28.010000000000002 108.743 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . . . -54.11 -45.73 71.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.382 -0.826 . . . . 34.899999999999999 110.565 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -65.85 -42.86 89.94 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 114.64 1.348 . . . . 38.75 114.64 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LYS . . . . . 0.609 ' NZ ' ' O ' ' A' ' 76' ' ' ARG . 18.6 mmtt -65.62 -25.38 67.35 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 114.662 1.356 . . . . 30.170000000000002 114.662 179.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.11 -16.76 62.58 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 125.791 1.636 . . . . 32.530000000000001 111.402 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . . . -78.67 -22.71 46.36 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 124.084 0.865 . . . . 31.809999999999999 111.909 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -84.7 14.83 4.28 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.923 0.889 . . . . 32.890000000000001 109.934 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.3 tp -110.54 133.06 53.64 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 122.065 0.936 . . . . 35.640000000000001 111.305 -167.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.09 89.39 5.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.363 -1.29 . . . . 40.609999999999999 108.451 175.667 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 19.0 mt -96.51 173.9 7.12 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 124.045 0.841 . . . . 41.579999999999998 109.563 -171.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 145' ' ' VAL . . . -114.2 135.98 53.45 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 123.772 0.829 . . . . 42.210000000000001 111.067 -167.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . . . -57.67 5.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 117.234 2.309 . . . . 43.75 117.234 -163.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ASP . . . . . 0.57 ' OD2' ' N ' ' A' ' 144' ' ' ASP . 0.0 OUTLIER -110.91 -19.86 12.65 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.285 1.434 . . . . 45.060000000000002 109.926 170.775 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 142' ' ' ALA . 21.6 t -99.25 101.15 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-O 121.588 0.708 . . . . 38.399999999999999 109.754 -175.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 71.2 p -60.1 143.7 51.5 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.235 -1.348 . . . . 35.030000000000001 110.574 161.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -45.69 -35.18 4.0 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.936 -1.029 . . . . 41.780000000000001 112.0 163.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . . . -67.1 -43.62 82.04 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 112.966 0.728 . . . . 32.289999999999999 112.966 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . . . -72.29 -39.21 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 107.063 -1.458 . . . . 31.129999999999999 107.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.5 92.38 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 119.964 -0.694 . . . . 24.73 111.266 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 39.2 tp -61.57 -48.08 82.59 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 120.503 0.192 . . . . 28.789999999999999 111.189 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 34.1 tttt -58.34 -47.27 84.28 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.163 1.172 . . . . 38.170000000000002 114.163 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -61.7 -48.55 80.26 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 121.604 0.716 . . . . 24.68 110.559 177.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 73.8 mt -60.95 -41.79 96.97 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.655 1.724 . . . . 26.870000000000001 115.655 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' MSE . . . . . . . . . . . . . 20.0 mmt -70.38 -40.68 73.84 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 112.537 0.569 . . . . 49.340000000000003 112.537 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -60.19 -50.78 72.32 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.166 0.916 . . . . 30.399999999999999 111.832 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -49.25 -54.08 18.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.523 0.677 . . . . 33.299999999999997 110.464 169.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.07 -32.69 74.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.301 1.593 . . . . 45.200000000000003 115.301 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.77 -24.95 13.28 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 111.678 0.251 . . . . 37.990000000000002 111.678 -173.996 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -66.4 -41.31 94.5 Favored Glycine 0 C--O 1.189 -2.692 0 CA-C-O 119.6 -0.556 . . . . 36.469999999999999 113.052 165.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -57.78 -43.71 85.74 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 118.124 0.962 . . . . 40.340000000000003 110.608 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -63.75 -55.4 23.43 Favored 'General case' 0 N--CA 1.419 -2.011 0 CA-C-N 114.735 -1.121 . . . . 43.939999999999998 111.675 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -48.82 -43.68 38.58 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 115.529 1.677 . . . . 52.140000000000001 115.529 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.77 -43.46 98.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.084 0 N-CA-C 113.5 0.926 . . . . 39.799999999999997 113.5 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -80.44 -29.74 37.56 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 119.139 -1.024 . . . . 43.530000000000001 111.58 -174.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.01 -31.81 72.6 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.122 -0.696 . . . . 36.100000000000001 109.122 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -82.38 -45.12 15.28 Favored 'General case' 0 C--O 1.199 -1.605 0 O-C-N 124.865 1.353 . . . . 57.32 112.298 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 37.6 m -65.99 -33.63 76.25 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 111.969 0.359 . . . . 33.390000000000001 111.969 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -103.6 6.07 36.96 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 113.454 0.909 . . . . 30.649999999999999 113.454 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -49.12 126.41 12.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.606 0.717 . . . . 43.880000000000003 110.305 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 76.99 -3.52 57.04 Favored Glycine 0 C--O 1.227 -0.309 0 N-CA-C 115.842 1.097 . . . . 36.740000000000002 115.842 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . . . -129.78 60.47 51.87 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.149 0.98 . . . . 35.960000000000001 110.245 -168.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.64 -39.35 91.99 Favored 'Trans proline' 0 C--N 1.359 1.08 1 C-N-CA 125.64 4.226 . . . . 32.590000000000003 116.849 177.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . . . -63.05 -29.51 70.87 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 112.908 0.707 . . . . 30.460000000000001 112.908 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 -39.15 50.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.443 -0.344 . . . . 35.240000000000002 111.163 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.65 -47.32 82.58 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.908 0.755 . . . . 28.010000000000002 110.747 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -63.72 -37.26 86.68 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 109.803 -0.443 . . . . 35.57 109.803 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . . . . -67.36 -36.45 81.41 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 112.469 0.544 . . . . 32.07 112.469 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -92.15 -8.42 45.68 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.181 1.548 . . . . 31.960000000000001 115.181 -177.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' MSE . . . . . . . . . . . . . 59.2 tpp -39.13 -63.01 0.58 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 117.167 2.284 . . . . 57.649999999999999 117.167 -176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . 0.308 24.3 p30 -79.09 -19.62 50.79 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 116.881 -1.928 . . . . 41.060000000000002 114.688 -171.792 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 50.4 m -63.22 -50.68 69.3 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 119.113 0.87 . . . . 30.210000000000001 113.263 158.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 47.1 mt -53.64 -46.67 70.62 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 114.395 1.258 . . . . 30.579999999999998 114.395 172.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' VAL . . . . . . . . . . . . . 92.3 t -57.14 -44.84 84.02 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.531 0 CA-C-O 121.621 0.724 . . . . 25.300000000000001 112.239 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.79 -36.21 78.0 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.496 0.924 . . . . 41.759999999999998 113.496 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.68 -39.97 91.87 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 108.782 -0.822 . . . . 39.909999999999997 108.782 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 55.6 t -63.77 -46.58 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 124.481 1.113 . . . . 33.630000000000003 111.415 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . . . -51.96 -47.51 64.76 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 120.514 -0.474 . . . . 28.949999999999999 110.649 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' VAL . . . . . . . . . . . . . 74.0 t -69.67 -42.44 80.39 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 O-C-N 123.625 0.578 . . . . 28.43 111.115 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' MSE . . . . . . . . . . . . . 48.0 mtm -60.7 -38.81 86.27 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.904 1.816 . . . . 44.710000000000001 115.904 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' LEU . . . . . . . . . . . . . 70.5 mt -68.84 -31.02 69.68 Favored 'General case' 0 C--O 1.263 1.815 0 N-CA-C 112.91 0.707 . . . . 27.82 112.91 173.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 43.6 mtm-85 -70.69 -35.71 72.91 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 118.61 -0.709 . . . . 38.710000000000001 112.645 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 95.5 mt -61.04 -49.02 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.443 0 CA-C-N 118.315 0.507 . . . . 21.109999999999999 111.121 168.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 48.6 mt -58.9 -49.71 76.77 Favored 'General case' 0 C--O 1.205 -1.244 0 O-C-N 120.975 -1.078 . . . . 19.649999999999999 112.138 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . . . -54.37 -48.55 71.35 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.104 -0.238 . . . . 24.329999999999998 110.445 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -65.89 -41.92 90.94 Favored 'General case' 0 C--O 1.196 -1.717 0 N-CA-C 112.949 0.722 . . . . 33.439999999999998 112.949 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -73.65 -24.26 74.99 Favored Glycine 0 CA--C 1.497 -1.093 0 CA-C-O 121.808 0.671 . . . . 21.52 113.753 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' MSE . . . . . . . . . . . . . 13.8 ttm -89.2 -28.84 19.71 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.483 -0.859 . . . . 41.310000000000002 112.505 -174.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' THR . . . . . . . . . . . . . 14.8 p -114.0 170.51 8.22 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 114.689 1.366 . . . . 31.09 114.689 -171.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.643 0 CA-C-N 113.854 -1.521 . . . . 32.229999999999997 113.895 -177.786 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.495 ' O ' ' NH1' ' A' ' 5' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . 0.567 ' O ' ' N ' ' A' ' 107' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . 0.402 ' O ' ' ND2' ' A' ' 46' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 113.329 0.862 . . . . 73.59 113.329 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 28.7 mtt -112.21 175.24 5.51 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.062 -1.088 . . . . 68.27 108.062 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.43 150.29 31.45 Favored 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 108.852 -0.796 . . . . 57.14 108.852 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.2 p -61.47 160.09 11.67 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 107.553 -1.277 . . . . 51.77 107.553 167.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -60.98 -33.41 73.18 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.732 -0.787 . . . . 51.56 113.029 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.0 ttt-85 -71.82 -41.22 68.46 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.6 0.714 . . . . 61.41 109.847 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -70.58 -29.83 66.36 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 121.347 -0.845 . . . . 48.33 112.238 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.86 -42.66 85.28 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.467 -0.77 . . . . 40.53 110.897 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.41 -48.61 84.49 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.379 0 CA-C-N 114.069 -1.423 . . . . 42.3 114.769 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.64 -34.95 67.8 Favored 'General case' 0 C--O 1.2 -1.532 0 O-C-N 120.646 -1.284 . . . . 42.3 113.478 172.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.7 tttm -72.38 -48.36 42.22 Favored 'General case' 0 C--O 1.199 -1.56 0 O-C-N 121.127 -0.983 . . . . 43.63 112.538 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.89 -45.63 78.54 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 118.565 -0.731 . . . . 39.24 111.764 170.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.02 -55.24 37.33 Favored 'General case' 0 C--O 1.279 2.615 0 O-C-N 123.715 0.634 . . . . 39.91 112.638 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.0 t -46.8 -45.41 7.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 N-CA-C 113.337 0.866 . . . . 41.91 113.337 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -67.13 -45.99 75.46 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 115.874 1.805 . . . . 52.39 115.874 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -77.51 -39.46 27.45 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.42 0 CA-C-N 119.202 0.91 . . . . 44.73 112.0 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -60.98 -51.27 69.95 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 121.227 -0.921 . . . . 45.06 109.887 173.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.25 -35.2 69.61 Favored Glycine 0 C--O 1.219 -0.833 0 O-C-N 121.238 -0.914 . . . . 47.25 115.083 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -74.31 -43.15 57.93 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 115.087 1.514 . . . . 51.37 115.087 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -110.34 -20.17 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.418 1.636 . . . . 52.4 115.418 -170.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.91 174.45 47.98 Favored Glycine 0 C--O 1.214 -1.117 0 N-CA-C 109.137 -1.585 . . . . 48.13 109.137 -173.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' CB ' HG12 ' A' ' 109' ' ' VAL . 83.5 t80 -69.28 -43.75 73.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.409 0.892 . . . . 51.8 113.409 -169.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -72.31 -42.47 65.4 Favored 'General case' 0 C--O 1.218 -0.604 0 C-N-CA 123.216 0.606 . . . . 59.77 111.917 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -78.98 -30.44 44.38 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.437 0.903 . . . . 60.1 113.437 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.19 139.87 58.04 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.068 -1.086 . . . . 53.16 108.068 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.1 p -112.7 147.56 36.54 Favored 'General case' 0 N--CA 1.439 -1.014 0 O-C-N 124.221 0.951 . . . . 52.71 108.748 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 p -72.65 -25.98 61.48 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.955 -0.566 . . . . 52.47 112.157 177.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.16 -46.35 89.38 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 122.29 1.043 . . . . 62.61 108.777 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -65.46 -36.22 83.25 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.426 1.269 . . . . 58.75 114.426 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.61 -41.37 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.54 1.136 . . . . 48.58 111.452 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.22 96.2 Favored 'General case' 0 CA--C 1.503 -0.834 0 C-N-CA 122.591 0.356 . . . . 45.8 111.349 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -68.25 -37.02 80.32 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 120.379 -0.528 . . . . 44.36 110.228 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -67.09 -34.3 77.34 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.127 0.788 . . . . 52.01 113.127 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.54 -12.32 56.31 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 124.166 0.916 . . . . 44.4 112.752 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.15 46.23 58.92 Favored Glycine 0 C--N 1.339 0.746 0 N-CA-C 109.297 -1.521 . . . . 47.13 109.297 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 22.5 m -133.4 148.74 30.86 Favored 'Isoleucine or valine' 0 C--O 1.244 0.782 0 C-N-CA 124.417 1.087 . . . . 47.91 109.623 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.12 146.05 12.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.289 -0.634 . . . . 49.35 109.289 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -55.31 -47.65 75.29 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.911 0.862 . . . . 51.8 111.269 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -38.2 -40.21 0.84 Allowed Glycine 0 N--CA 1.48 1.582 0 N-CA-C 119.309 2.484 . . . . 52.57 119.309 165.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 20.7 mt -62.95 -24.03 67.68 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.38 2.363 . . . . 58.53 117.38 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.5 mt -71.53 -46.1 64.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.036 -1.098 . . . . 54.49 108.036 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -52.2 -49.02 64.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 119.538 -0.865 . . . . 49.78 110.379 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -53.63 -51.48 62.97 Favored 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 113.073 0.768 . . . . 48.78 113.073 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.12 -39.55 29.3 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 115.566 1.691 . . . . 52.24 115.566 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . 0.586 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 93.5 m-85 -116.44 -3.3 11.9 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 119.67 3.211 . . . . 52.91 119.67 -172.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 44' ' ' PHE . . . 73.33 -63.12 0.45 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 122.355 2.343 . . . . 51.86 116.053 175.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -149.13 -179.78 7.3 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.821 0.737 . . . . 52.24 111.355 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -71.96 -34.24 68.82 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 123.502 0.501 . . . . 52.36 111.98 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 113' ' ' LEU . 16.2 tt0 -62.16 -45.2 94.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.247 1.022 . . . . 55.8 112.42 176.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -64.83 -41.63 95.59 Favored 'General case' 0 CA--C 1.56 1.353 0 N-CA-C 115.071 1.508 . . . . 43.29 115.071 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.452 HD13 ' CD1' ' A' ' 44' ' ' PHE . 28.8 tp -57.26 -51.37 69.64 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 109.701 -0.481 . . . . 35.39 109.701 171.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -55.14 -46.57 75.69 Favored 'General case' 0 C--O 1.189 -2.109 0 N-CA-C 113.826 1.047 . . . . 32.32 113.826 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -64.41 -45.04 89.32 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 112.759 0.651 . . . . 35.61 112.759 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -66.13 -40.99 91.1 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 119.037 -0.506 . . . . 46.64 111.867 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.96 -37.31 86.58 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 113.576 0.954 . . . . 31.96 113.576 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.28 -44.4 79.38 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.872 -1.142 . . . . 36.19 112.471 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MSE . . . . . 0.716 ' HE1' HG23 ' A' ' 117' ' ' ILE . 21.3 mmt -60.7 -40.6 92.84 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 111.637 0.236 . . . . 59.44 111.637 173.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.2 t -65.24 -43.15 92.31 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 112.702 0.63 . . . . 37.13 112.702 -179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.98 -38.37 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.611 1.196 . . . . 33.08 111.036 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . 0.601 HG21 HD21 ' A' ' 121' ' ' LEU . 1.7 t -74.03 -29.14 61.77 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 114.486 -1.234 . . . . 42.71 113.954 -176.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . . . -72.29 -26.58 62.03 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.261 0.624 . . . . 37.06 112.391 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -65.61 -46.54 78.95 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 109.962 -0.384 . . . . 49.41 109.962 168.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.52 -52.2 64.39 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 112.563 0.579 . . . . 38.52 112.563 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -48.96 -35.01 14.1 Favored 'General case' 0 C--O 1.204 -1.292 0 O-C-N 124.235 0.959 . . . . 45.63 111.38 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . . . -76.9 -44.49 31.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 119.109 -0.472 . . . . 41.3 112.175 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -47.77 -48.78 29.97 Favored 'General case' 0 C--O 1.205 -1.253 0 N-CA-C 108.758 -0.83 . . . . 45.12 108.758 165.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -61.95 -49.42 76.19 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 114.86 1.43 . . . . 38.28 114.86 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.829 ' HB3' ' HE3' ' A' ' 71' ' ' MSE . 24.5 mt-10 -59.1 -38.78 80.36 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 119.107 -0.473 . . . . 42.94 110.858 177.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -56.44 -49.45 74.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.46 0.647 . . . . 34.72 110.664 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -65.47 -45.86 82.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 119.402 -0.919 . . . . 29.88 111.98 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.22 -58.4 6.27 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 124.244 0.965 . . . . 33.37 110.827 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' MSE . . . . . 0.829 ' HE3' ' HB3' ' A' ' 67' ' ' GLU . 45.7 mtt -50.7 -34.38 26.51 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 124.241 0.963 . . . . 55.72 109.799 -168.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -88.85 -44.13 10.71 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 113.789 1.033 . . . . 38.29 113.789 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -95.37 4.35 53.46 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 115.952 1.834 . . . . 33.28 115.952 -175.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -33.97 -41.24 0.1 Allowed 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 117.51 2.411 . . . . 36.87 117.51 172.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -88.15 1.19 54.94 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.246 1.572 . . . . 38.47 115.246 -172.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . 0.551 ' O ' ' NZ ' ' A' ' 135' ' ' LYS . 51.3 mtt-85 -76.96 165.83 24.14 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 121.678 0.751 . . . . 37.74 109.855 -175.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.68 139.31 57.84 Favored 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 106.041 -1.837 . . . . 28.07 106.041 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.3 tp -62.85 -35.71 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 113.474 0.916 . . . . 27.74 113.474 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -66.74 -42.34 86.41 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.793 0.683 . . . . 23.44 111.102 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -61.6 -45.7 92.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.275 1.43 . . . . 30.15 111.687 172.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -55.0 -49.62 71.07 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.76 -1.564 . . . . 28.47 110.327 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 81.2 mtp -65.25 -51.08 63.12 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 117.982 2.586 . . . . 51.37 117.982 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . 0.551 ' HG3' ' HG2' ' A' ' 188' ' ' LYS . 6.8 tm-20 -39.54 -55.9 1.74 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.632 -0.258 . . . . 31.29 110.647 172.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -75.19 -31.96 61.1 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 112.211 0.449 . . . . 40.27 112.211 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -68.72 -39.28 80.48 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 118.638 -1.225 . . . . 33.36 112.01 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.8 mt -65.31 -41.1 90.56 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.32 -0.863 . . . . 31.97 111.556 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -53.36 -50.04 65.88 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.227 0.611 . . . . 40.82 111.994 173.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -59.28 -39.76 83.96 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.331 -0.85 . . . . 36.26 112.943 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -66.88 -37.38 84.3 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.585 0.958 . . . . 45.95 113.585 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HB3' 'SE ' ' A' ' 180' ' ' MSE . 38.4 mt -59.22 -54.32 48.23 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.133 0.973 . . . . 31.68 110.944 173.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . . . -56.09 -44.14 78.73 Favored 'General case' 0 CA--C 1.558 1.263 0 CA-C-N 114.612 -1.177 . . . . 32.64 112.568 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -59.9 -47.4 85.93 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 119.93 1.241 . . . . 37.44 113.41 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -57.97 -37.9 75.06 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.844 1.424 . . . . 36.16 114.844 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.26 -34.77 71.03 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 123.033 0.533 . . . . 36.57 111.725 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 81.3 p -88.53 -16.71 31.94 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 123.919 0.762 . . . . 37.54 111.942 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -126.2 57.67 21.27 Favored Pre-proline 0 N--CA 1.494 1.739 0 N-CA-C 115.893 1.812 . . . . 34.3 115.893 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.11 -36.41 97.94 Favored 'Trans proline' 0 CA--C 1.551 1.373 0 N-CA-C 116.799 1.807 . . . . 31.61 116.799 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.0 mp0 -64.62 -45.71 85.72 Favored 'General case' 0 C--O 1.26 1.62 0 O-C-N 121.503 -0.748 . . . . 45.51 111.581 -179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -55.74 -42.75 75.82 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 115.231 1.567 . . . . 40.14 115.231 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.75 78.21 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.198 0.999 . . . . 29.85 112.393 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . 0.486 ' O ' HG22 ' A' ' 104' ' ' ILE . 77.8 m-20 -60.64 -33.77 73.28 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.452 -0.899 . . . . 45.07 110.747 178.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -73.34 -42.94 61.68 Favored 'General case' 0 C--O 1.252 1.201 0 O-C-N 121.924 -0.485 . . . . 32.7 110.731 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.76 -34.58 71.58 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.437 1.113 . . . . 34.05 112.154 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 101' ' ' ASP . . . -75.79 -12.44 14.59 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.287 0 O-C-N 121.323 -0.861 . . . . 36.61 112.881 -174.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 38.3 p -74.03 -11.98 60.49 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.509 -0.744 . . . . 36.46 112.881 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . 0.705 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -47.92 -35.31 10.39 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.791 1.281 . . . . 40.13 110.21 -178.234 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . 0.497 ' N ' ' O ' ' A' ' 216' ' ' HOH . 3.2 p -67.32 -29.33 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.826 0 N-CA-C 118.968 2.951 . . . . 45.58 118.968 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . . . -70.3 -18.51 63.11 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 116.81 2.152 . . . . 48.18 116.81 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.705 HG22 ' O ' ' A' ' 106' ' ' LEU . 28.4 m -80.0 156.56 4.54 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 N-CA-C 113.42 0.896 . . . . 48.58 113.42 -169.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -56.9 141.64 44.25 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.163 0.431 . . . . 59.43 112.163 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -51.84 -34.64 41.43 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.324 -0.853 . . . . 50.9 111.45 -168.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.46 -6.82 89.08 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 117.502 1.761 . . . . 48.78 117.502 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . 0.582 HD13 ' HG3' ' A' ' 48' ' ' GLU . 45.1 tp -97.22 -38.81 9.55 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 117.502 0.651 . . . . 46.47 109.308 165.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . 0.411 ' HG3' HD22 ' A' ' 106' ' ' LEU . 8.1 ttm105 -64.69 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 117.907 -1.517 . . . . 57.61 110.261 178.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -62.81 -47.84 81.71 Favored 'General case' 0 C--O 1.209 -1.057 0 C-N-CA 123.701 0.8 . . . . 45.45 111.344 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -52.39 -50.32 62.7 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 124.294 0.996 . . . . 41.79 110.963 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . 0.716 HG23 ' HE1' ' A' ' 56' ' ' MSE . 54.6 mt -57.61 -42.01 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.601 0.593 . . . . 36.24 112.601 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.63 -39.7 70.22 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.265 0.469 . . . . 40.84 112.265 -174.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 85.1 mt -52.35 -52.09 55.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 124.013 0.925 . . . . 38.28 111.098 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -74.45 -22.05 59.3 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.466 -0.788 . . . . 42.85 110.842 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . 0.601 HD21 HG21 ' A' ' 59' ' ' THR . 46.9 mt -91.2 -16.66 27.31 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.101 0.778 . . . . 39.93 113.101 178.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -52.7 -40.1 62.62 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.937 0.717 . . . . 36.01 112.937 -170.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . . . -67.21 -39.56 86.32 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.795 -0.817 . . . . 38.06 108.795 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 p -81.47 -40.52 23.15 Favored 'General case' 0 CA--C 1.551 1.002 0 O-C-N 123.481 0.488 . . . . 38.41 110.338 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -60.52 -32.24 71.27 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.816 1.043 . . . . 44.4 113.816 169.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -63.44 -22.9 67.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 117.825 -1.083 . . . . 39.69 113.48 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.91 -51.61 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.634 0 CA-C-N 120.729 1.604 . . . . 34.53 112.843 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.9 -47.79 79.19 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 120.855 -1.153 . . . . 39.1 111.0 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -52.33 -49.15 64.84 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.016 -0.993 . . . . 33.33 111.825 177.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.88 -20.92 66.0 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 113.933 1.086 . . . . 38.66 113.933 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -80.39 -44.59 19.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.724 -1.125 . . . . 32.31 109.254 -178.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.35 -46.76 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.307 0 CA-C-N 115.112 -0.949 . . . . 28.01 108.743 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . . . -54.11 -45.73 71.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.382 -0.826 . . . . 34.9 110.565 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -65.85 -42.86 89.94 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 114.64 1.348 . . . . 38.75 114.64 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LYS . . . . . 0.551 ' NZ ' ' O ' ' A' ' 76' ' ' ARG . 18.6 mmtt -65.62 -25.38 67.35 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 114.662 1.356 . . . . 30.17 114.662 179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . 0.472 HD23 HD22 ' A' ' 139' ' ' LEU . 11.0 mt -71.11 -16.76 62.58 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 125.791 1.636 . . . . 32.53 111.402 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . . . -78.67 -22.71 46.36 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 124.084 0.865 . . . . 31.81 111.909 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -84.7 14.83 4.28 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.923 0.889 . . . . 32.89 109.934 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . 0.472 HD22 HD23 ' A' ' 136' ' ' LEU . 5.3 tp -110.54 133.06 53.64 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 122.065 0.936 . . . . 35.64 111.305 -167.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' A' ' 199' ' ' THR . 0.8 OUTLIER -81.09 89.39 5.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.363 -1.29 . . . . 40.61 108.451 175.667 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 19.0 mt -96.51 173.9 7.12 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 124.045 0.841 . . . . 41.58 109.563 -171.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -114.2 135.98 53.45 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 123.772 0.829 . . . . 42.21 111.067 -167.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . . . -57.67 5.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 117.234 2.309 . . . . 43.75 117.234 -163.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ASP . . . . . 0.57 ' OD2' ' N ' ' A' ' 144' ' ' ASP . 0.0 OUTLIER -110.91 -19.86 12.65 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.285 1.434 . . . . 45.06 109.926 170.775 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.25 101.15 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-O 121.588 0.708 . . . . 38.4 109.754 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 71.2 p -60.1 143.7 51.5 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.235 -1.348 . . . . 35.03 110.574 161.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -45.69 -35.18 4.0 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.936 -1.029 . . . . 41.78 112.0 163.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . . . -67.1 -43.62 82.04 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 112.966 0.728 . . . . 32.29 112.966 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . . . -72.29 -39.21 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 107.063 -1.458 . . . . 31.13 107.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.5 92.38 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 119.964 -0.694 . . . . 24.73 111.266 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 39.2 tp -61.57 -48.08 82.59 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 120.503 0.192 . . . . 28.79 111.189 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 34.1 tttt -58.34 -47.27 84.28 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.163 1.172 . . . . 38.17 114.163 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -61.7 -48.55 80.26 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 121.604 0.716 . . . . 24.68 110.559 177.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 73.8 mt -60.95 -41.79 96.97 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.655 1.724 . . . . 26.87 115.655 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' MSE . . . . . 0.523 ' HE2' ' HA ' ' A' ' 155' ' ' MSE . 20.0 mmt -70.38 -40.68 73.84 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 112.537 0.569 . . . . 49.34 112.537 -178.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -60.19 -50.78 72.32 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.166 0.916 . . . . 35.68 111.832 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -49.25 -54.08 18.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.523 0.677 . . . . 33.3 110.464 169.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.07 -32.69 74.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.301 1.593 . . . . 45.2 115.301 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.77 -24.95 13.28 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 111.678 0.251 . . . . 37.99 111.678 -173.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -66.4 -41.31 94.5 Favored Glycine 0 C--O 1.189 -2.692 0 CA-C-O 119.6 -0.556 . . . . 36.47 113.052 165.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -57.78 -43.71 85.74 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 118.124 0.962 . . . . 40.34 110.608 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -63.75 -55.4 23.43 Favored 'General case' 0 N--CA 1.419 -2.011 0 CA-C-N 114.735 -1.121 . . . . 43.94 111.675 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -48.82 -43.68 38.58 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 115.529 1.677 . . . . 52.14 115.529 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.77 -43.46 98.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.084 0 N-CA-C 113.5 0.926 . . . . 39.8 113.5 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -80.44 -29.74 37.56 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 119.139 -1.024 . . . . 43.53 111.58 -174.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.01 -31.81 72.6 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.122 -0.696 . . . . 36.1 109.122 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -82.38 -45.12 15.28 Favored 'General case' 0 C--O 1.199 -1.605 0 O-C-N 124.865 1.353 . . . . 57.32 112.298 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 37.6 m -65.99 -33.63 76.25 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 111.969 0.359 . . . . 33.39 111.969 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -103.6 6.07 36.96 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 113.454 0.909 . . . . 30.65 113.454 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -49.12 126.41 12.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.606 0.717 . . . . 43.88 110.305 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 76.99 -3.52 57.04 Favored Glycine 0 C--O 1.227 -0.309 0 N-CA-C 115.842 1.097 . . . . 36.74 115.842 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . . . -129.78 60.47 51.87 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.149 0.98 . . . . 35.96 110.245 -168.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.64 -39.35 91.99 Favored 'Trans proline' 0 C--N 1.359 1.08 1 C-N-CA 125.64 4.226 . . . . 32.59 116.849 177.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . . . -63.05 -29.51 70.87 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 112.908 0.707 . . . . 30.46 112.908 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 -39.15 50.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.443 -0.344 . . . . 35.24 111.163 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.65 -47.32 82.58 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.908 0.755 . . . . 28.01 110.747 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -63.72 -37.26 86.68 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 109.803 -0.443 . . . . 35.57 109.803 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . . . . -67.36 -36.45 81.41 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 112.469 0.544 . . . . 32.07 112.469 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -92.15 -8.42 45.68 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.181 1.548 . . . . 31.96 115.181 -177.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' MSE . . . . . 0.473 'SE ' ' HB3' ' A' ' 90' ' ' LEU . 59.2 tpp -39.13 -63.01 0.58 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 117.167 2.284 . . . . 57.65 117.167 -176.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . 0.308 24.3 p30 -79.09 -19.62 50.79 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 116.881 -1.928 . . . . 41.06 114.688 -171.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 50.4 m -63.22 -50.68 69.3 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 119.113 0.87 . . . . 30.21 113.263 158.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 187' ' ' VAL . 47.1 mt -53.64 -46.67 70.62 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 114.395 1.258 . . . . 30.58 114.395 172.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 180' ' ' MSE . 92.3 t -57.14 -44.84 84.02 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.531 0 CA-C-O 121.621 0.724 . . . . 25.3 112.239 175.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 185' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.79 -36.21 78.0 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.496 0.924 . . . . 41.76 113.496 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.68 -39.97 91.87 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 108.782 -0.822 . . . . 39.91 108.782 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 183' ' ' LEU . 55.6 t -63.77 -46.58 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 124.481 1.113 . . . . 33.63 111.415 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LYS . . . . . 0.551 ' HG2' ' HG3' ' A' ' 83' ' ' GLU . . . -51.96 -47.51 64.76 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 120.514 -0.474 . . . . 28.95 110.649 175.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 189' ' ' VAL . . . . . . . . . . . . . 74.0 t -69.67 -42.44 80.39 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 O-C-N 123.625 0.578 . . . . 28.43 111.115 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' MSE . . . . . . . . . . . . . 48.0 mtm -60.7 -38.81 86.27 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.904 1.816 . . . . 44.71 115.904 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' LEU . . . . . . . . . . . . . 70.5 mt -68.84 -31.02 69.68 Favored 'General case' 0 C--O 1.263 1.815 0 N-CA-C 112.91 0.707 . . . . 27.82 112.91 173.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 43.6 mtm-85 -70.69 -35.71 72.91 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 118.61 -0.709 . . . . 38.71 112.645 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 95.5 mt -61.04 -49.02 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.443 0 CA-C-N 118.315 0.507 . . . . 21.11 111.121 168.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' LEU . . . . . 0.573 ' O ' ' HB2' ' A' ' 198' ' ' MSE . 48.6 mt -58.9 -49.71 76.77 Favored 'General case' 0 C--O 1.205 -1.244 0 O-C-N 120.975 -1.078 . . . . 19.65 112.138 177.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . . . -54.37 -48.55 71.35 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.104 -0.238 . . . . 24.33 110.445 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -65.89 -41.92 90.94 Favored 'General case' 0 C--O 1.196 -1.717 0 N-CA-C 112.949 0.722 . . . . 33.44 112.949 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -73.65 -24.26 74.99 Favored Glycine 0 CA--C 1.497 -1.093 0 CA-C-O 121.808 0.671 . . . . 21.52 113.753 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' MSE . . . . . 0.573 ' HB2' ' O ' ' A' ' 194' ' ' LEU . 13.8 ttm -89.2 -28.84 19.71 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.483 -0.859 . . . . 41.31 112.505 -174.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 140' ' ' ASP . 14.8 p -114.0 170.51 8.22 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 114.689 1.366 . . . . 31.09 114.689 -171.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.643 0 CA-C-N 113.854 -1.521 . . . . 32.23 113.895 -177.786 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . 0.497 ' O ' ' N ' ' A' ' 107' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 113.329 0.862 . . . . 73.59 113.329 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 28.7 mtt -112.21 175.24 5.51 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.062 -1.088 . . . . 68.27 108.062 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.43 150.29 31.45 Favored 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 108.852 -0.796 . . . . 57.14 108.852 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.2 p -61.47 160.09 11.67 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 107.553 -1.277 . . . . 51.77 107.553 167.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -60.98 -33.41 73.18 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.732 -0.787 . . . . 51.56 113.029 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.0 ttt-85 -71.82 -41.22 68.46 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.6 0.714 . . . . 61.41 109.847 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -70.58 -29.83 66.36 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 121.347 -0.845 . . . . 48.33 112.238 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.86 -42.66 85.28 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.467 -0.77 . . . . 40.53 110.897 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.41 -48.61 84.49 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.379 0 CA-C-N 114.069 -1.423 . . . . 42.3 114.769 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.64 -34.95 67.8 Favored 'General case' 0 C--O 1.2 -1.532 0 O-C-N 120.646 -1.284 . . . . 42.3 113.478 172.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.7 tttm -72.38 -48.36 42.22 Favored 'General case' 0 C--O 1.199 -1.56 0 O-C-N 121.127 -0.983 . . . . 43.63 112.538 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.89 -45.63 78.54 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 118.565 -0.731 . . . . 39.24 111.764 170.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.02 -55.24 37.33 Favored 'General case' 0 C--O 1.279 2.615 0 O-C-N 123.715 0.634 . . . . 39.91 112.638 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.0 t -46.8 -45.41 7.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 N-CA-C 113.337 0.866 . . . . 41.91 113.337 173.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -67.13 -45.99 75.46 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 115.874 1.805 . . . . 52.39 115.874 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.0 t -77.51 -39.46 27.45 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.42 0 CA-C-N 119.202 0.91 . . . . 44.73 112.0 -177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -60.98 -51.27 69.95 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 121.227 -0.921 . . . . 45.06 109.887 173.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.25 -35.2 69.61 Favored Glycine 0 C--O 1.219 -0.833 0 O-C-N 121.238 -0.914 . . . . 47.25 115.083 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -74.31 -43.15 57.93 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 115.087 1.514 . . . . 51.37 115.087 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -110.34 -20.17 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.418 1.636 . . . . 52.4 115.418 -170.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.91 174.45 47.98 Favored Glycine 0 C--O 1.214 -1.117 0 N-CA-C 109.137 -1.585 . . . . 48.13 109.137 -173.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' CB ' HG12 ' A' ' 109' ' ' VAL . 83.5 t80 -69.28 -43.75 73.23 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.409 0.892 . . . . 51.8 113.409 -169.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -72.31 -42.47 65.4 Favored 'General case' 0 C--O 1.218 -0.604 0 C-N-CA 123.216 0.606 . . . . 59.77 111.917 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -78.98 -30.44 44.38 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.437 0.903 . . . . 60.1 113.437 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.19 139.87 58.04 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.068 -1.086 . . . . 53.16 108.068 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.1 p -112.7 147.56 36.54 Favored 'General case' 0 N--CA 1.439 -1.014 0 O-C-N 124.221 0.951 . . . . 52.71 108.748 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 p -72.65 -25.98 61.48 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.955 -0.566 . . . . 52.47 112.157 177.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.16 -46.35 89.38 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 122.29 1.043 . . . . 62.61 108.777 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -65.46 -36.22 83.25 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.426 1.269 . . . . 58.75 114.426 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.61 -41.37 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.54 1.136 . . . . 48.58 111.452 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.22 96.2 Favored 'General case' 0 CA--C 1.503 -0.834 0 C-N-CA 122.591 0.356 . . . . 45.8 111.349 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -68.25 -37.02 80.32 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 120.379 -0.528 . . . . 44.36 110.228 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -67.09 -34.3 77.34 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.127 0.788 . . . . 52.01 113.127 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.54 -12.32 56.31 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 124.166 0.916 . . . . 44.4 112.752 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.15 46.23 58.92 Favored Glycine 0 C--N 1.339 0.746 0 N-CA-C 109.297 -1.521 . . . . 47.13 109.297 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 22.5 m -133.4 148.74 30.86 Favored 'Isoleucine or valine' 0 C--O 1.244 0.782 0 C-N-CA 124.417 1.087 . . . . 47.91 109.623 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.12 146.05 12.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.289 -0.634 . . . . 49.35 109.289 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . . . -55.31 -47.65 75.29 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.911 0.862 . . . . 51.8 111.269 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -38.2 -40.21 0.84 Allowed Glycine 0 N--CA 1.48 1.582 0 N-CA-C 119.309 2.484 . . . . 52.57 119.309 165.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 20.7 mt -62.95 -24.03 67.68 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.38 2.363 . . . . 58.53 117.38 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.5 mt -71.53 -46.1 64.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.036 -1.098 . . . . 54.49 108.036 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -52.2 -49.02 64.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 119.538 -0.865 . . . . 49.78 110.379 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -53.63 -51.48 62.97 Favored 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 113.073 0.768 . . . . 48.78 113.073 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.12 -39.55 29.3 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 115.566 1.691 . . . . 52.24 115.566 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.586 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 93.5 m-85 -116.44 -3.3 11.9 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 119.67 3.211 . . . . 52.91 119.67 -172.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 44' ' ' PHE . . . 73.33 -63.12 0.45 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 122.355 2.343 . . . . 51.86 116.053 175.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -149.13 -179.78 7.3 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.821 0.737 . . . . 52.24 111.355 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -71.96 -34.24 68.82 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 123.502 0.501 . . . . 52.36 111.98 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 113' ' ' LEU . 16.2 tt0 -62.16 -45.2 94.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.247 1.022 . . . . 55.8 112.42 176.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -64.83 -41.63 95.59 Favored 'General case' 0 CA--C 1.56 1.353 0 N-CA-C 115.071 1.508 . . . . 43.29 115.071 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.452 HD13 ' CD1' ' A' ' 44' ' ' PHE . 28.8 tp -57.26 -51.37 69.64 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 109.701 -0.481 . . . . 35.39 109.701 171.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -55.14 -46.57 75.69 Favored 'General case' 0 C--O 1.189 -2.109 0 N-CA-C 113.826 1.047 . . . . 32.32 113.826 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -64.41 -45.04 89.32 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 112.759 0.651 . . . . 35.61 112.759 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -66.13 -40.99 91.1 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 119.037 -0.506 . . . . 46.64 111.867 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.96 -37.31 86.58 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 113.576 0.954 . . . . 31.96 113.576 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.28 -44.4 79.38 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.872 -1.142 . . . . 36.19 112.471 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MSE . . . . . 0.716 ' HE1' HG23 ' A' ' 117' ' ' ILE . 21.3 mmt -60.7 -40.6 92.84 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 111.637 0.236 . . . . 59.44 111.637 173.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.2 t -65.24 -43.15 92.31 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 112.702 0.63 . . . . 37.13 112.702 -179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.7 t -71.98 -38.37 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.611 1.196 . . . . 33.08 111.036 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . 0.601 HG21 HD21 ' A' ' 121' ' ' LEU . 1.7 t -74.03 -29.14 61.77 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 114.486 -1.234 . . . . 42.71 113.954 -176.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . . . -72.29 -26.58 62.03 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.261 0.624 . . . . 37.06 112.391 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -65.61 -46.54 78.95 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 109.962 -0.384 . . . . 49.41 109.962 168.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.52 -52.2 64.39 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 112.563 0.579 . . . . 38.52 112.563 176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -48.96 -35.01 14.1 Favored 'General case' 0 C--O 1.204 -1.292 0 O-C-N 124.235 0.959 . . . . 45.63 111.38 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . . . -76.9 -44.49 31.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 119.109 -0.472 . . . . 41.3 112.175 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -47.77 -48.78 29.97 Favored 'General case' 0 C--O 1.205 -1.253 0 N-CA-C 108.758 -0.83 . . . . 45.12 108.758 165.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -61.95 -49.42 76.19 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 114.86 1.43 . . . . 38.28 114.86 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.829 ' HB3' ' HE3' ' A' ' 71' ' ' MSE . 24.5 mt-10 -59.1 -38.78 80.36 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 119.107 -0.473 . . . . 42.94 110.858 177.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -56.44 -49.45 74.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.46 0.647 . . . . 34.72 110.664 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -65.47 -45.86 82.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 119.402 -0.919 . . . . 29.88 111.98 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.4 tp -51.22 -58.4 6.27 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 124.244 0.965 . . . . 33.37 110.827 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' MSE . . . . . 0.829 ' HE3' ' HB3' ' A' ' 67' ' ' GLU . 45.7 mtt -50.7 -34.38 26.51 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 124.241 0.963 . . . . 55.72 109.799 -168.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -88.85 -44.13 10.71 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 113.789 1.033 . . . . 38.29 113.789 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -95.37 4.35 53.46 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 115.952 1.834 . . . . 33.28 115.952 -175.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.6 ttm-85 -33.97 -41.24 0.1 Allowed 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 117.51 2.411 . . . . 36.87 117.51 172.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -88.15 1.19 54.94 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.246 1.572 . . . . 38.47 115.246 -172.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.551 ' O ' ' NZ ' ' A' ' 135' ' ' LYS . 51.3 mtt-85 -76.96 165.83 24.14 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 121.678 0.751 . . . . 37.74 109.855 -175.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.68 139.31 57.84 Favored 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 106.041 -1.837 . . . . 28.07 106.041 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.3 tp -62.85 -35.71 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 113.474 0.916 . . . . 27.74 113.474 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -66.74 -42.34 86.41 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.793 0.683 . . . . 23.44 111.102 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -61.6 -45.7 92.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.275 1.43 . . . . 30.15 111.687 172.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -55.0 -49.62 71.07 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.76 -1.564 . . . . 28.47 110.327 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 81.2 mtp -65.25 -51.08 63.12 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 117.982 2.586 . . . . 51.37 117.982 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.551 ' HG3' ' HG2' ' A' ' 188' ' ' LYS . 6.8 tm-20 -39.54 -55.9 1.74 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.632 -0.258 . . . . 31.29 110.647 172.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -75.19 -31.96 61.1 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 112.211 0.449 . . . . 40.27 112.211 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -68.72 -39.28 80.48 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 118.638 -1.225 . . . . 33.36 112.01 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.8 mt -65.31 -41.1 90.56 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.32 -0.863 . . . . 31.97 111.556 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -53.36 -50.04 65.88 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.227 0.611 . . . . 40.82 111.994 173.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -59.28 -39.76 83.96 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.331 -0.85 . . . . 36.26 112.943 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -66.88 -37.38 84.3 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.585 0.958 . . . . 45.95 113.585 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HB3' 'SE ' ' A' ' 180' ' ' MSE . 38.4 mt -59.22 -54.32 48.23 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.133 0.973 . . . . 31.68 110.944 173.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . . . -56.09 -44.14 78.73 Favored 'General case' 0 CA--C 1.558 1.263 0 CA-C-N 114.612 -1.177 . . . . 32.64 112.568 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -59.9 -47.4 85.93 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 119.93 1.241 . . . . 37.44 113.41 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -57.97 -37.9 75.06 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.844 1.424 . . . . 36.16 114.844 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.26 -34.77 71.03 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 123.033 0.533 . . . . 36.57 111.725 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 81.3 p -88.53 -16.71 31.94 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 123.919 0.762 . . . . 37.54 111.942 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -126.2 57.67 21.27 Favored Pre-proline 0 N--CA 1.494 1.739 0 N-CA-C 115.893 1.812 . . . . 34.3 115.893 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.11 -36.41 97.94 Favored 'Trans proline' 0 CA--C 1.551 1.373 0 N-CA-C 116.799 1.807 . . . . 31.61 116.799 -174.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.0 mp0 -64.62 -45.71 85.72 Favored 'General case' 0 C--O 1.26 1.62 0 O-C-N 121.503 -0.748 . . . . 45.51 111.581 -179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -55.74 -42.75 75.82 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 115.231 1.567 . . . . 40.14 115.231 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.75 78.21 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.198 0.999 . . . . 29.85 112.393 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.486 ' O ' HG22 ' A' ' 104' ' ' ILE . 77.8 m-20 -60.64 -33.77 73.28 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.452 -0.899 . . . . 45.07 110.747 178.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -73.34 -42.94 61.68 Favored 'General case' 0 C--O 1.252 1.201 0 O-C-N 121.924 -0.485 . . . . 32.7 110.731 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.76 -34.58 71.58 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.437 1.113 . . . . 34.05 112.154 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 101' ' ' ASP . . . -75.79 -12.44 14.59 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.287 0 O-C-N 121.323 -0.861 . . . . 36.61 112.881 -174.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 38.3 p -74.03 -11.98 60.49 Favored 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 121.509 -0.744 . . . . 36.46 112.881 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.705 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -47.92 -35.31 10.39 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.791 1.281 . . . . 40.13 110.21 -178.234 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.497 ' N ' ' O ' ' A' ' 216' ' ' HOH . 3.2 p -67.32 -29.33 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.826 0 N-CA-C 118.968 2.951 . . . . 45.58 118.968 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . . . -70.3 -18.51 63.11 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 116.81 2.152 . . . . 48.18 116.81 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.705 HG22 ' O ' ' A' ' 106' ' ' LEU . 28.4 m -80.0 156.56 4.54 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 N-CA-C 113.42 0.896 . . . . 48.58 113.42 -169.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -56.9 141.64 44.25 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.163 0.431 . . . . 59.43 112.163 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . . . -51.84 -34.64 41.43 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.324 -0.853 . . . . 50.9 111.45 -168.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.46 -6.82 89.08 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 117.502 1.761 . . . . 48.78 117.502 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.582 HD13 ' HG3' ' A' ' 48' ' ' GLU . 45.1 tp -97.22 -38.81 9.55 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 117.502 0.651 . . . . 46.47 109.308 165.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.411 ' HG3' HD22 ' A' ' 106' ' ' LEU . 8.1 ttm105 -64.69 -36.96 85.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 117.907 -1.517 . . . . 57.61 110.261 178.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -62.81 -47.84 81.71 Favored 'General case' 0 C--O 1.209 -1.057 0 C-N-CA 123.701 0.8 . . . . 45.45 111.344 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -52.39 -50.32 62.7 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 124.294 0.996 . . . . 41.79 110.963 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.716 HG23 ' HE1' ' A' ' 56' ' ' MSE . 54.6 mt -57.61 -42.01 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.601 0.593 . . . . 36.24 112.601 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.4 mt -71.63 -39.7 70.22 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.265 0.469 . . . . 40.84 112.265 -174.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 85.1 mt -52.35 -52.09 55.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 124.013 0.925 . . . . 38.28 111.098 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -74.45 -22.05 59.3 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.466 -0.788 . . . . 42.85 110.842 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.601 HD21 HG21 ' A' ' 59' ' ' THR . 46.9 mt -91.2 -16.66 27.31 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.101 0.778 . . . . 39.93 113.101 178.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -52.7 -40.1 62.62 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.937 0.717 . . . . 36.01 112.937 -170.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . . . -67.21 -39.56 86.32 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.795 -0.817 . . . . 38.06 108.795 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 p -81.47 -40.52 23.15 Favored 'General case' 0 CA--C 1.551 1.002 0 O-C-N 123.481 0.488 . . . . 38.41 110.338 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -60.52 -32.24 71.27 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.816 1.043 . . . . 44.4 113.816 169.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -63.44 -22.9 67.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 117.825 -1.083 . . . . 39.69 113.48 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.91 -51.61 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.634 0 CA-C-N 120.729 1.604 . . . . 34.53 112.843 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -63.9 -47.79 79.19 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 120.855 -1.153 . . . . 39.1 111.0 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -52.33 -49.15 64.84 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 115.016 -0.993 . . . . 33.33 111.825 177.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -66.88 -20.92 66.0 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 113.933 1.086 . . . . 38.66 113.933 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -80.39 -44.59 19.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.724 -1.125 . . . . 32.31 109.254 -178.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.35 -46.76 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.307 0 CA-C-N 115.112 -0.949 . . . . 28.01 108.743 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . . . -54.11 -45.73 71.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.382 -0.826 . . . . 34.9 110.565 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -65.85 -42.86 89.94 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 114.64 1.348 . . . . 38.75 114.64 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LYS . . . . . 0.551 ' NZ ' ' O ' ' A' ' 76' ' ' ARG . 18.6 mmtt -65.62 -25.38 67.35 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 114.662 1.356 . . . . 30.17 114.662 179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.472 HD23 HD22 ' A' ' 139' ' ' LEU . 11.0 mt -71.11 -16.76 62.58 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 125.791 1.636 . . . . 32.53 111.402 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . . . -78.67 -22.71 46.36 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 124.084 0.865 . . . . 31.81 111.909 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -84.7 14.83 4.28 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.923 0.889 . . . . 32.89 109.934 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.472 HD22 HD23 ' A' ' 136' ' ' LEU . 5.3 tp -110.54 133.06 53.64 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 122.065 0.936 . . . . 35.64 111.305 -167.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.507 ' O ' ' HB ' ' A' ' 199' ' ' THR . 0.8 OUTLIER -81.09 89.39 5.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.363 -1.29 . . . . 40.61 108.451 175.667 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 19.0 mt -96.51 173.9 7.12 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 124.045 0.841 . . . . 41.58 109.563 -171.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -114.2 135.98 53.45 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 123.772 0.829 . . . . 42.21 111.067 -167.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . . . -57.67 5.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 117.234 2.309 . . . . 43.75 117.234 -163.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.57 ' OD2' ' N ' ' A' ' 144' ' ' ASP . 0.0 OUTLIER -110.91 -19.86 12.65 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.285 1.434 . . . . 45.06 109.926 170.775 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.25 101.15 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-O 121.588 0.708 . . . . 38.4 109.754 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 71.2 p -60.1 143.7 51.5 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.235 -1.348 . . . . 35.03 110.574 161.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -45.69 -35.18 4.0 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.936 -1.029 . . . . 41.78 112.0 163.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . . . -67.1 -43.62 82.04 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 112.966 0.728 . . . . 32.29 112.966 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . . . -72.29 -39.21 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 107.063 -1.458 . . . . 31.13 107.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.5 92.38 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 119.964 -0.694 . . . . 24.73 111.266 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 39.2 tp -61.57 -48.08 82.59 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 120.503 0.192 . . . . 28.79 111.189 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 34.1 tttt -58.34 -47.27 84.28 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.163 1.172 . . . . 38.17 114.163 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -61.7 -48.55 80.26 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-O 121.604 0.716 . . . . 24.68 110.559 177.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 73.8 mt -60.95 -41.79 96.97 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 115.655 1.724 . . . . 26.87 115.655 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' MSE . . . . . 0.523 ' HE2' ' HA ' ' A' ' 155' ' ' MSE . 20.0 mmt -70.38 -40.68 73.84 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 112.537 0.569 . . . . 49.34 112.537 -178.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -60.19 -50.78 72.32 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.166 0.916 . . . . 35.68 111.832 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -49.25 -54.08 18.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.523 0.677 . . . . 33.3 110.464 169.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.07 -32.69 74.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.301 1.593 . . . . 45.2 115.301 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.77 -24.95 13.28 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 111.678 0.251 . . . . 37.99 111.678 -173.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -66.4 -41.31 94.5 Favored Glycine 0 C--O 1.189 -2.692 0 CA-C-O 119.6 -0.556 . . . . 36.47 113.052 165.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -57.78 -43.71 85.74 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 118.124 0.962 . . . . 40.34 110.608 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -63.75 -55.4 23.43 Favored 'General case' 0 N--CA 1.419 -2.011 0 CA-C-N 114.735 -1.121 . . . . 43.94 111.675 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -48.82 -43.68 38.58 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 115.529 1.677 . . . . 52.14 115.529 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.77 -43.46 98.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.084 0 N-CA-C 113.5 0.926 . . . . 39.8 113.5 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -80.44 -29.74 37.56 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 119.139 -1.024 . . . . 43.53 111.58 -174.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.01 -31.81 72.6 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.122 -0.696 . . . . 36.1 109.122 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -82.38 -45.12 15.28 Favored 'General case' 0 C--O 1.199 -1.605 0 O-C-N 124.865 1.353 . . . . 57.32 112.298 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 37.6 m -65.99 -33.63 76.25 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 111.969 0.359 . . . . 33.39 111.969 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -103.6 6.07 36.96 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 113.454 0.909 . . . . 30.65 113.454 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -49.12 126.41 12.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.606 0.717 . . . . 43.88 110.305 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 76.99 -3.52 57.04 Favored Glycine 0 C--O 1.227 -0.309 0 N-CA-C 115.842 1.097 . . . . 36.74 115.842 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LYS . . . . . . . . . . . . . . . -129.78 60.47 51.87 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.149 0.98 . . . . 35.96 110.245 -168.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.64 -39.35 91.99 Favored 'Trans proline' 0 C--N 1.359 1.08 1 C-N-CA 125.64 4.226 . . . . 32.59 116.849 177.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' GLU . . . . . . . . . . . . . . . -63.05 -29.51 70.87 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 112.908 0.707 . . . . 30.46 112.908 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 -39.15 50.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.443 -0.344 . . . . 35.24 111.163 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.65 -47.32 82.58 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.908 0.755 . . . . 28.01 110.747 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -63.72 -37.26 86.68 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 109.803 -0.443 . . . . 35.57 109.803 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . . . . -67.36 -36.45 81.41 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 112.469 0.544 . . . . 32.07 112.469 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -92.15 -8.42 45.68 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.181 1.548 . . . . 31.96 115.181 -177.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' MSE . . . . . 0.473 'SE ' ' HB3' ' A' ' 90' ' ' LEU . 59.2 tpp -39.13 -63.01 0.58 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 117.167 2.284 . . . . 57.65 117.167 -176.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . 0.308 24.3 p30 -79.09 -19.62 50.79 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 116.881 -1.928 . . . . 41.06 114.688 -171.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 50.4 m -63.22 -50.68 69.3 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 119.113 0.87 . . . . 30.21 113.263 158.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 187' ' ' VAL . 47.1 mt -53.64 -46.67 70.62 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 114.395 1.258 . . . . 30.58 114.395 172.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 180' ' ' MSE . 92.3 t -57.14 -44.84 84.02 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.531 0 CA-C-O 121.621 0.724 . . . . 25.3 112.239 175.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -68.79 -36.21 78.0 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.496 0.924 . . . . 41.76 113.496 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.68 -39.97 91.87 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 108.782 -0.822 . . . . 39.91 108.782 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 183' ' ' LEU . 55.6 t -63.77 -46.58 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 124.481 1.113 . . . . 33.63 111.415 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LYS . . . . . 0.551 ' HG2' ' HG3' ' A' ' 83' ' ' GLU . . . -51.96 -47.51 64.76 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 120.514 -0.474 . . . . 28.95 110.649 175.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' VAL . . . . . . . . . . . . . 74.0 t -69.67 -42.44 80.39 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 O-C-N 123.625 0.578 . . . . 28.43 111.115 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' MSE . . . . . . . . . . . . . 48.0 mtm -60.7 -38.81 86.27 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.904 1.816 . . . . 44.71 115.904 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' LEU . . . . . . . . . . . . . 70.5 mt -68.84 -31.02 69.68 Favored 'General case' 0 C--O 1.263 1.815 0 N-CA-C 112.91 0.707 . . . . 27.82 112.91 173.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 43.6 mtm-85 -70.69 -35.71 72.91 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 118.61 -0.709 . . . . 38.71 112.645 173.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ILE . . . . . . . . . . . . . 95.5 mt -61.04 -49.02 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.443 0 CA-C-N 118.315 0.507 . . . . 21.11 111.121 168.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.573 ' O ' ' HB2' ' A' ' 198' ' ' MSE . 48.6 mt -58.9 -49.71 76.77 Favored 'General case' 0 C--O 1.205 -1.244 0 O-C-N 120.975 -1.078 . . . . 19.65 112.138 177.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' LYS . . . . . . . . . . . . . . . -54.37 -48.55 71.35 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.104 -0.238 . . . . 24.33 110.445 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 12.3 tttp -65.89 -41.92 90.94 Favored 'General case' 0 C--O 1.196 -1.717 0 N-CA-C 112.949 0.722 . . . . 33.44 112.949 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -73.65 -24.26 74.99 Favored Glycine 0 CA--C 1.497 -1.093 0 CA-C-O 121.808 0.671 . . . . 21.52 113.753 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' MSE . . . . . 0.573 ' HB2' ' O ' ' A' ' 194' ' ' LEU . 13.8 ttm -89.2 -28.84 19.71 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.483 -0.859 . . . . 41.31 112.505 -174.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 140' ' ' ASP . 14.8 p -114.0 170.51 8.22 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 114.689 1.366 . . . . 31.09 114.689 -171.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.643 0 CA-C-N 113.854 -1.521 . . . . 32.23 113.895 -177.786 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . 0.497 ' O ' ' N ' ' A' ' 107' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_