data_3nwh_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 3nwh _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 ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 113.078 0.77 . . . . 114.09 113.078 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -55.03 -87.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.287 -1.005 . . . . 102.93000000000001 108.287 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.3 m -64.15 -9.88 19.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 117.096 2.258 . . . . 90.349999999999994 117.096 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.43 -26.87 65.55 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 115.013 1.486 . . . . 114.68000000000001 115.013 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.77 -41.48 26.49 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.517 0.562 . . . . 69.010000000000005 112.517 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.81 -40.46 88.5 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.276 0.843 . . . . 49.039999999999999 113.276 170.002 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.34 -58.85 6.16 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 124.296 1.038 . . . . 105.78 110.012 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -57.89 -41.18 82.0 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.449 -0.796 . . . . 71.579999999999998 111.536 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.02 -40.88 92.02 Favored Glycine 0 C--O 1.2 -2.022 0 CA-C-N 114.559 -1.201 . . . . 41.649999999999999 112.051 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.3 mt -69.73 -39.28 76.9 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.423 -1.045 . . . . 33.060000000000002 112.87 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -65.3 -45.73 83.23 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.38 0.61 . . . . 81.549999999999997 110.917 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.49 -40.09 65.09 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 107.867 -1.16 . . . . 39.149999999999999 107.867 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -68.13 -41.86 84.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 C-N-CA 119.57 -0.852 . . . . 30.34 109.818 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' MSE . . . . . . . . . . . . . 11.0 mmt -64.09 -39.96 95.19 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 114.05 -1.432 . . . . 71.980000000000004 111.775 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -64.97 -37.15 86.7 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 107.381 -1.34 . . . . 52.229999999999997 107.381 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 68.5 m -60.78 -43.02 98.61 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.797 -1.161 . . . . 31.850000000000001 110.014 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 12.6 ttm-85 -62.04 -43.46 98.79 Favored 'General case' 0 C--N 1.29 -2.007 0 C-N-CA 120.087 -0.645 . . . . 44.909999999999997 109.754 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -66.1 -41.31 90.81 Favored 'General case' 0 C--O 1.2 -1.509 0 C-N-CA 118.521 -1.272 . . . . 40.979999999999997 112.703 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.5 t -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-N 114.997 -1.001 . . . . 35.82 111.067 176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . 0.285 2.3 p -67.84 -31.19 70.86 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 116.295 -2.162 . . . . 30.949999999999999 113.879 -179.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -53.91 -44.18 70.33 Favored 'General case' 0 N--CA 1.512 2.642 0 CA-C-N 119.501 1.046 . . . . 37.780000000000001 110.265 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.61 -40.68 95.7 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-O 122.874 1.321 . . . . 35.890000000000001 111.807 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 tp -54.32 -57.22 12.09 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.696 -1.138 . . . . 25.16 111.936 170.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -48.05 -42.61 28.91 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.293 0.37 . . . . 28.34 110.498 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.07 -47.86 81.12 Favored 'General case' 0 C--O 1.245 0.837 0 C-N-CA 119.34 -0.944 . . . . 36.530000000000001 109.519 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' D' ' 58' ' ' ARG . 45.5 mm-40 -69.91 -31.46 69.26 Favored 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 116.513 -2.075 . . . . 33.350000000000001 111.824 -174.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 23.3 mt -64.85 -38.18 90.1 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 120.754 -1.216 . . . . 23.690000000000001 112.694 173.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.6 m -58.15 -45.1 88.02 Favored 'General case' 0 C--O 1.197 -1.69 0 N-CA-C 108.186 -1.042 . . . . 29.0 108.186 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . 0.431 ' CG ' ' O ' ' A' ' 12' ' ' HOH . 3.4 tp10 -61.28 -46.02 92.07 Favored 'General case' 0 CA--C 1.56 1.355 0 N-CA-C 114.235 1.198 . . . . 45.509999999999998 114.235 174.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.63 -35.62 61.16 Favored 'General case' 0 N--CA 1.523 3.224 0 O-C-N 120.993 -1.067 . . . . 24.920000000000002 113.091 169.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -71.76 -40.09 69.54 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.357 -0.838 . . . . 55.130000000000003 109.841 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' A' ' 80' ' ' GLY . 32.7 tttt -54.92 -57.53 11.25 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 104.455 -2.424 . . . . 53.159999999999997 104.455 173.474 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 79' ' ' LYS . . . -31.84 -59.12 0.34 Allowed Glycine 0 C--N 1.291 -1.953 0 CA-C-N 115.417 -0.81 . . . . 22.739999999999998 113.535 176.522 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -71.45 -37.7 71.38 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 118.595 1.198 . . . . 32.350000000000001 113.403 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -55.51 -53.39 56.9 Favored 'General case' 0 C--O 1.199 -1.572 0 N-CA-C 104.889 -2.263 . . . . 43.719999999999999 104.889 175.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -63.82 -38.99 93.15 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 120.111 -1.618 . . . . 30.43 114.112 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.2 t -58.0 -45.44 88.0 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 O-C-N 120.643 -1.286 . . . . 28.41 110.442 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -51.84 -43.38 63.17 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.299 0.852 . . . . 59.130000000000003 113.299 167.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -55.65 -60.5 3.36 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.658 -1.608 . . . . 35.75 106.658 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -54.68 -39.48 68.16 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.364 1.616 . . . . 35.549999999999997 115.364 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' ' C ' ' A' ' 89' ' ' ALA . . . -60.74 -43.32 98.08 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.776 -1.194 . . . . 35.109999999999999 107.776 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . 0.445 ' C ' ' O ' ' A' ' 88' ' ' ALA . . . -56.58 -53.18 60.57 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 104.51 -2.404 . . . . 40.740000000000002 104.51 -173.653 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.4 m -51.98 -48.31 64.44 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.906 1.282 . . . . 35.479999999999997 111.999 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.44 -41.9 98.66 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 114.352 1.242 . . . . 52.869999999999997 114.352 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.8 -37.59 84.96 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.934 0.873 . . . . 65.950000000000003 110.999 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -64.46 -48.28 75.86 Favored 'General case' 0 C--O 1.21 -1.012 0 N-CA-C 107.848 -1.167 . . . . 49.020000000000003 107.848 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.2 m -52.13 -49.3 63.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 119.531 -0.867 . . . . 47.200000000000003 108.951 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -51.35 70.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 122.168 -0.332 . . . . 51.619999999999997 110.934 -177.251 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' MSE . . . . . . . . . . . . . 25.0 mtp -61.49 -36.12 79.6 Favored 'General case' 0 C--O 1.214 -0.81 0 O-C-N 124.608 1.193 . . . . 136.81 110.536 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -73.56 -41.74 62.57 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.398 -0.921 . . . . 58.740000000000002 109.348 -178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.96 -40.99 95.49 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.166 -0.47 . . . . 51.450000000000003 111.188 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' MSE . . . . . . . . . . . . . 10.7 mtp -68.8 -41.95 77.97 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.429 0.633 . . . . 106.19 112.134 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -50.03 -58.95 4.42 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.517 -1.29 . . . . 54.909999999999997 107.517 172.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . 0.273 0.1 OUTLIER -72.79 -13.54 61.33 Favored 'General case' 0 C--O 1.206 -1.209 0 C-N-CA 119.759 -0.777 . . . . 51.520000000000003 111.803 -169.736 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.49 -54.27 9.74 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.158 -0.682 . . . . 57.200000000000003 109.158 166.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -49.18 -52.46 26.51 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 115.613 -0.721 . . . . 69.560000000000002 111.221 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' A' ' 105' ' ' GLU . . . -46.72 -63.94 0.89 Allowed 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.362 -0.977 . . . . 50.770000000000003 108.362 174.102 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 104' ' ' ALA . 12.6 tp10 -45.47 -51.09 12.07 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.997 -1.081 . . . . 61.170000000000002 111.626 -175.296 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -52.23 -45.93 65.5 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.099 1.148 . . . . 75.200000000000003 114.099 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.91 -54.23 14.37 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.861 0.864 . . . . 66.870000000000005 111.235 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.3 mm-40 -54.96 -39.72 69.23 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 122.119 0.961 . . . . 85.939999999999998 108.412 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -65.69 -53.6 30.46 Favored Glycine 0 N--CA 1.476 1.349 0 CA-C-N 114.14 -1.391 . . . . 56.009999999999998 113.279 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -8.55 57.57 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.999 -0.68 . . . . 84.739999999999995 109.839 -175.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -77.08 -43.72 33.26 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 114.93 -1.032 . . . . 82.010000000000005 109.523 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.2 -46.49 64.45 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 120.093 -0.643 . . . . 74.409999999999997 109.82 -178.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 42.2 t -44.03 -52.46 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.86 -0.336 . . . . 49.869999999999997 110.986 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.05 -34.25 77.65 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.503 0.557 . . . . 77.769999999999996 112.503 -174.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.94 -34.83 77.34 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.838 -0.619 . . . . 84.400000000000006 111.103 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.4 mt -89.54 -27.87 19.99 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.981 -1.008 . . . . 48.020000000000003 111.675 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -70.33 -34.19 72.38 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 119.278 -0.969 . . . . 71.200000000000003 109.697 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -56.39 25.39 Favored Glycine 0 C--N 1.311 -0.811 0 N-CA-C 108.542 -1.823 . . . . 57.479999999999997 108.542 173.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -29.84 71.12 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.399 0.889 . . . . 63.039999999999999 113.399 -174.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mt -62.05 -45.04 99.61 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.948 -1.13 . . . . 43.210000000000001 107.948 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.62 -59.01 4.49 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.068 -1.423 . . . . 55.990000000000002 111.789 -179.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 p -61.76 -41.04 97.16 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.475 -0.935 . . . . 56.979999999999997 108.475 -176.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.3 mt -63.24 -32.13 73.46 Favored 'General case' 0 C--O 1.196 -1.727 0 C-N-CA 120.256 -0.578 . . . . 45.649999999999999 111.978 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -66.97 -44.3 80.84 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.242 1.02 . . . . 48.590000000000003 108.919 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 64.7 m170 -58.85 -47.16 85.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.479 -1.237 . . . . 62.009999999999998 108.294 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -62.78 -32.33 73.47 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-N 114.719 -1.128 . . . . 53.520000000000003 110.257 -174.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 17.0 tp -75.77 -31.63 59.58 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.774 0.797 . . . . 37.719999999999999 110.479 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -67.63 -34.75 77.6 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 118.665 -1.214 . . . . 57.759999999999998 109.829 173.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -72.08 -50.42 28.39 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 116.364 -0.38 . . . . 51.18 111.675 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -44.1 81.53 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.445 -0.798 . . . . 36.229999999999997 112.853 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 38.2 m -67.95 -33.59 74.96 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 118.948 -1.101 . . . . 37.920000000000002 111.674 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.04 -45.63 84.62 Favored 'General case' 0 C--O 1.209 -1.072 0 N-CA-C 106.386 -1.709 . . . . 43.490000000000002 106.386 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.77 -33.24 75.23 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.695 -1.138 . . . . 60.68 111.399 -175.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 48.5 t -65.97 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 CA-C-N 115.33 -0.85 . . . . 42.899999999999999 112.734 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -80.46 -29.31 37.48 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 107.943 -1.132 . . . . 65.450000000000003 107.943 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -60.64 -57.17 13.86 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.16 -1.422 . . . . 66.060000000000002 107.16 175.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 26.4 mt -66.12 -26.81 67.62 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.534 0.939 . . . . 43.649999999999999 113.534 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 34.6 ttm105 -65.73 -46.25 79.62 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.133 -1.427 . . . . 62.25 112.687 170.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 92.6 mtm-85 -60.39 -58.73 7.25 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 118.59 -1.244 . . . . 69.120000000000005 108.316 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -46.37 -41.6 13.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.57 0.7 . . . . 61.060000000000002 111.633 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.84 -53.55 56.9 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.998 -1.001 . . . . 57.990000000000002 110.206 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -62.07 -37.36 84.71 Favored 'General case' 0 C--O 1.207 -1.183 0 N-CA-C 108.296 -1.002 . . . . 65.25 108.296 -171.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 13.8 t -65.45 -30.83 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 112.72 0.637 . . . . 49.359999999999999 112.72 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 75.8 mt -82.68 -41.54 19.24 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 119.914 -0.714 . . . . 48.460000000000001 110.288 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 3.3 m -46.84 -51.23 17.05 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.351 -0.84 . . . . 53.530000000000001 110.615 168.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.64 -47.14 94.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 113.047 0.758 . . . . 56.210000000000001 113.047 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -55.8 -16.05 3.98 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 114.827 1.418 . . . . 65.090000000000003 114.827 171.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 20.4 mt -89.61 -42.56 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 121.374 0.607 . . . . 71.939999999999998 111.548 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.89 -46.18 90.16 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.111 0.782 . . . . 92.260000000000005 113.111 170.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.43 4.49 12.99 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.269 0.557 . . . . 92.170000000000002 110.371 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 34.8 tttt -82.56 -48.06 11.42 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.637 -0.71 . . . . 131.11000000000001 111.243 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 5.4 mttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.387 0.613 . . . . 93.129999999999995 111.231 174.815 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.512 2.635 0 N-CA-C 112.168 0.432 . . . . 87.450000000000003 112.168 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.85 26.34 4.14 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.444 1.116 . . . . 106.41 110.484 167.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -91.06 -43.92 9.62 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 114.504 -1.225 . . . . 80.079999999999998 111.578 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -53.13 -35.88 60.18 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.264 -1.335 . . . . 75.859999999999999 109.938 165.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -72.25 -46.23 56.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.937 0.717 . . . . 117.84 112.937 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.55 -42.23 92.14 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.367 -0.533 . . . . 66.040000000000006 111.293 173.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 6.3 m -55.65 -50.93 68.89 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.028 -1.069 . . . . 49.009999999999998 109.133 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -45.43 -56.98 4.42 Favored 'General case' 0 C--O 1.2 -1.543 0 CA-C-N 114.776 -1.102 . . . . 72.230000000000004 113.075 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -57.26 -50.72 71.99 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.611 -0.681 . . . . 73.920000000000002 109.865 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -40.77 -54.26 3.55 Favored Glycine 0 N--CA 1.487 2.037 0 O-C-N 125.431 1.707 . . . . 44.359999999999999 112.068 170.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.28 -36.47 84.2 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 113.574 0.953 . . . . 38.240000000000002 113.574 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -57.06 -52.91 63.38 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 112.697 0.628 . . . . 89.840000000000003 112.697 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.41 -40.72 78.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.125 0.964 . . . . 44.5 111.502 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.78 -41.84 92.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 C-N-CA 118.797 -1.161 . . . . 34.990000000000002 110.805 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' MSE . . . . . . . . . . . . . 23.9 ttp -68.37 -40.31 81.46 Favored 'General case' 0 C--O 1.206 -1.23 0 N-CA-C 113.056 0.761 . . . . 80.459999999999994 113.056 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -55.36 -39.58 70.23 Favored 'General case' 0 C--O 1.209 -1.061 0 CA-C-O 121.265 0.555 . . . . 60.479999999999997 110.486 169.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.48 -42.84 91.76 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.133 -0.627 . . . . 35.850000000000001 111.292 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ARG . . . . . 0.431 ' CD ' ' O ' ' A' ' 11' ' ' HOH . 73.1 mtm180 -61.06 -52.87 63.11 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.557 -0.747 . . . . 46.240000000000002 112.631 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' B' ' 68' ' ' HIS . 79.8 m-20 -52.13 -45.13 64.85 Favored 'General case' 0 C--O 1.198 -1.613 0 C-N-CA 119.385 -0.926 . . . . 54.200000000000003 112.184 176.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 t -63.68 -48.14 87.99 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.969 0 CA-C-N 114.842 -1.072 . . . . 43.810000000000002 112.732 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 37.0 p -57.37 -22.69 44.25 Favored 'General case' 0 C--O 1.201 -1.448 0 C-N-CA 119.531 -0.868 . . . . 36.350000000000001 109.015 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . 0.437 ' CB ' ' O ' ' B' ' 65' ' ' ASN . 23.2 t-80 -60.51 -56.0 26.7 Favored 'General case' 0 C--O 1.193 -1.877 0 CA-C-N 114.926 -1.034 . . . . 68.810000000000002 110.367 175.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . 0.857 ' CD2' ' O ' ' B' ' 15' ' ' HOH . 6.8 mt -57.03 -43.51 81.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 122.005 0.907 . . . . 58.770000000000003 111.062 175.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 5.6 tp -50.99 -50.68 57.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.397 -1.274 . . . . 40.049999999999997 110.261 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -53.19 -50.11 65.32 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.786 -1.552 . . . . 69.069999999999993 110.161 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . 0.26 11.4 pt20 -71.76 -41.53 68.29 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.839 1.052 . . . . 71.079999999999998 113.839 -175.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -62.11 -31.32 71.77 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.643 -1.223 . . . . 56.149999999999999 108.159 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 25.8 mt -60.12 -37.54 80.35 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.691 0.758 . . . . 36.549999999999997 111.173 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 16.1 m -65.55 -38.57 89.97 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.047 -0.979 . . . . 49.060000000000002 109.563 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -66.04 -42.25 89.8 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 120.236 -0.586 . . . . 49.340000000000003 111.652 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.58 77.24 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 107.421 -1.326 . . . . 34.039999999999999 107.421 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.1 -39.86 93.73 Favored 'General case' 0 C--O 1.208 -1.1 0 O-C-N 121.9 -0.5 . . . . 57.649999999999999 110.834 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -60.04 -41.67 92.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.75 1.262 . . . . 61.439999999999998 108.698 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -55.63 -53.01 44.43 Favored Glycine 0 C--N 1.303 -1.257 0 CA-C-N 113.723 -1.581 . . . . 34.590000000000003 113.202 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -65.25 -31.21 72.25 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.891 -0.723 . . . . 45.020000000000003 111.067 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -74.78 -39.28 61.85 Favored 'General case' 0 C--O 1.209 -1.063 0 N-CA-C 109.021 -0.733 . . . . 62.710000000000001 109.021 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.05 -37.53 86.08 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.775 0.798 . . . . 49.840000000000003 110.688 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 1.5 t -63.33 -34.75 69.0 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 O-C-N 121.641 -0.662 . . . . 47.520000000000003 110.211 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -69.14 -46.86 66.56 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.552 0.691 . . . . 83.540000000000006 109.323 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.56 -50.89 66.87 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.421 -1.263 . . . . 62.920000000000002 108.31 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.49 -40.55 87.37 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.937 0.717 . . . . 72.650000000000006 112.937 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.57 62.92 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 121.35 0.595 . . . . 66.950000000000003 109.509 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -52.97 31.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.05 -0.977 . . . . 78.269999999999996 109.042 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 3.1 m -49.49 -40.37 37.19 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 114.396 -1.274 . . . . 70.269999999999996 110.768 171.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 14.0 t -70.89 -24.13 62.42 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.758 -1.11 . . . . 83.829999999999998 113.843 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -69.59 -59.08 3.2 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.661 -1.237 . . . . 118.01000000000001 107.661 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -34.22 -64.73 0.23 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.085 -1.871 . . . . 117.41 109.161 171.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 16.4 m -51.61 -40.72 60.38 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 115.632 1.716 . . . . 81.239999999999995 115.632 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.62 -35.84 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 N-CA-C 116.196 1.924 . . . . 99.120000000000005 116.196 -174.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' MSE . . . . . . . . . . . . . 20.3 mtm -69.93 -35.83 74.85 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.247 0.546 . . . . 161.21000000000001 110.108 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.14 -37.09 69.5 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.409 -1.269 . . . . 110.27 111.06 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 tp -59.81 -60.17 4.26 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.597 0.713 . . . . 97.340000000000003 110.422 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' MSE . . . . . . . . . . . . . 10.9 mtp -53.32 -46.65 69.54 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.326 -0.852 . . . . 148.97999999999999 110.265 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.2 72.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 115.344 -0.844 . . . . 123.09999999999999 110.118 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -49.02 73.36 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.389 -0.823 . . . . 103.8 110.693 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 31.4 tp -55.78 -51.64 66.72 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.131 -0.941 . . . . 97.900000000000006 110.221 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -53.47 -50.51 65.17 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 115.239 -0.891 . . . . 124.40000000000001 110.812 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.24 56.44 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.524 -0.762 . . . . 111.70999999999999 110.411 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -50.85 63.41 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.301 -0.863 . . . . 108.92 110.419 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LYS . . . . . 0.879 ' CD ' ' N ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -53.73 -54.53 36.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.97 0.89 . . . . 139.91 110.677 179.831 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . 0.879 ' N ' ' CD ' ' B' ' 106' ' ' LYS . . . -52.07 -50.11 62.19 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.032 -0.986 . . . . 116.19 110.456 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -54.64 -57.63 10.69 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.394 -0.821 . . . . 134.28 110.632 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLY . . . . . 0.745 ' O ' ' CG2' ' B' ' 113' ' ' VAL . . . -50.97 -43.89 49.72 Favored Glycine 0 N--CA 1.471 1.009 0 CA-C-N 115.152 -0.931 . . . . 86.549999999999997 111.854 179.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -62.17 -57.49 11.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.354 0.597 . . . . 130.22999999999999 111.17 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.16 -21.87 25.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.398 -0.819 . . . . 133.68000000000001 110.621 -179.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -107.31 33.86 3.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 116.44 111.569 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' VAL . . . . . 0.745 ' CG2' ' O ' ' B' ' 109' ' ' GLY . 62.0 t -135.04 -49.19 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.083 -1.451 . . . . 87.799999999999997 107.083 -179.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.21 -21.11 65.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.216 -0.902 . . . . 127.64 110.518 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -69.24 -51.14 40.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.571 -0.74 . . . . 111.19 109.24 166.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 2.3 mt -60.8 -40.9 94.41 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.991 1.108 . . . . 75.290000000000006 113.991 -179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . 0.269 12.2 pt-20 -83.88 -2.05 55.68 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.179 -1.408 . . . . 104.43000000000001 113.707 -175.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -80.86 -35.31 25.14 Favored Glycine 0 N--CA 1.474 1.173 0 N-CA-C 107.904 -2.078 . . . . 85.849999999999994 107.904 168.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.9 -53.28 60.13 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 113.925 -1.137 . . . . 90.879999999999995 109.613 169.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 mt -55.45 -47.59 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 112.672 0.619 . . . . 64.840000000000003 112.672 -174.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 71.0 p -69.66 -44.55 70.29 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 119.771 -0.771 . . . . 80.659999999999997 110.416 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 1.9 m -45.77 -51.0 13.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.517 0.511 . . . . 77.780000000000001 109.71 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.4 -41.04 98.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.44 -0.8 . . . . 60.960000000000001 110.483 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -59.05 -41.03 86.9 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 117.465 -1.694 . . . . 64.319999999999993 111.433 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -58.5 -70.87 0.13 Allowed 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.272 -0.876 . . . . 83.739999999999995 110.083 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -37.02 -50.0 0.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 120.659 -0.416 . . . . 70.090000000000003 111.544 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 28.0 tp -62.52 -45.44 92.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 119.299 -0.96 . . . . 49.439999999999998 110.592 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.52 -38.73 60.28 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.538 0.685 . . . . 79.870000000000005 109.868 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -75.91 -43.06 47.02 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 113.01 0.745 . . . . 70.25 113.01 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 119.218 -0.993 . . . . 49.5 109.079 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 20.0 m -71.1 -26.13 62.9 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.814 0.816 . . . . 51.810000000000002 110.079 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.07 -49.38 36.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.683 -1.144 . . . . 59.780000000000001 108.583 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -51.86 64.9 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.783 1.278 . . . . 61.490000000000002 108.326 177.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.05 -46.15 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 O-C-N 121.552 -0.718 . . . . 51.210000000000001 110.131 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -40.63 68.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.939 -1.101 . . . . 70.769999999999996 111.58 -176.112 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -55.12 -42.48 73.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.049 -1.093 . . . . 76.129999999999995 108.049 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 19.3 mt -79.46 -36.66 38.44 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.506 0.928 . . . . 53.049999999999997 113.506 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.3 -52.67 62.76 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.623 0.725 . . . . 73.870000000000005 110.424 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -61.89 -36.46 81.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.696 -1.138 . . . . 77.230000000000004 111.425 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -75.82 -35.22 60.09 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.177 0.513 . . . . 63.829999999999998 111.327 -175.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -68.62 -39.96 80.59 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.473 -1.24 . . . . 54.670000000000002 110.927 -177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -58.0 -48.75 79.1 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.06 -0.973 . . . . 66.0 111.105 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' VAL . . . . . . . . . . . . . 62.2 t -51.13 -54.5 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.602 -0.888 . . . . 58.68 108.602 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.4 -45.06 80.82 Favored 'General case' 0 C--O 1.209 -1.026 0 CA-C-N 114.191 -1.368 . . . . 55.25 111.487 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -69.6 -29.42 66.94 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 114.618 1.34 . . . . 58.700000000000003 114.618 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 44.5 t -73.3 -41.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 108.424 -0.954 . . . . 63.520000000000003 108.424 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -60.78 -19.22 58.92 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 113.764 1.024 . . . . 66.849999999999994 113.764 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mt -90.74 -35.61 7.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 114.167 -1.379 . . . . 66.680000000000007 108.782 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.39 70.31 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.709 -1.132 . . . . 74.840000000000003 108.997 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -72.6 -18.21 61.62 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 116.531 2.048 . . . . 78.540000000000006 116.531 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 113.822 1.045 . . . . 85.689999999999998 113.822 -172.357 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.345 0 CA-C-O 122.513 1.149 . . . . 102.29000000000001 109.979 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -56.4 18.58 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.655 -1.611 . . . . 108.17 107.692 170.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -57.38 -26.59 61.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.811 -1.541 . . . . 78.090000000000003 113.091 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -75.05 -46.88 31.85 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.762 1.393 . . . . 86.799999999999997 114.762 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.76 -44.18 81.51 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.884 0.85 . . . . 60.170000000000002 111.83 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' CYS . . . . . . . . . . . . . 5.9 m -59.76 -58.17 9.71 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.119 -0.491 . . . . 45.299999999999997 110.834 171.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -43.47 -52.26 6.17 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 115.119 -0.946 . . . . 67.290000000000006 109.238 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -76.3 -44.28 37.7 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 121.227 -0.921 . . . . 60.359999999999999 112.8 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' GLY . . . . . . . . . . . . . . . -52.26 -51.59 41.08 Favored Glycine 0 N--CA 1.485 1.939 0 CA-C-N 115.261 -0.881 . . . . 44.619999999999997 111.605 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' LEU . . . . . . . . . . . . . 3.2 tp -64.49 -39.59 94.08 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.444 0.64 . . . . 37.039999999999999 111.65 -174.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.89 -46.16 88.5 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-O 121.989 0.899 . . . . 85.209999999999994 110.472 178.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.03 -52.66 40.91 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.552 -1.204 . . . . 38.789999999999999 112.019 173.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 3.0 t -55.33 -46.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.54 -0.755 . . . . 38.359999999999999 108.973 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' MSE . . . . . . . . . . . . . 60.4 mmm -66.86 -37.07 83.73 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.358 0.599 . . . . 76.129999999999995 110.836 -175.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -63.36 -36.3 83.24 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.488 -0.778 . . . . 52.350000000000001 109.551 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' CYS . . . . . . . . . . . . . 73.3 m -69.87 -50.95 37.5 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.709 -0.678 . . . . 36.520000000000003 109.487 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -45.24 -54.31 7.18 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 123.056 1.408 . . . . 73.450000000000003 111.654 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -45.27 -57.13 4.21 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 124.383 2.039 . . . . 36.57 116.239 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.82 -26.12 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 112.822 -1.99 . . . . 30.25 112.762 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 34.0 p -71.06 -25.4 62.62 Favored 'General case' 0 CA--C 1.484 -1.574 0 C-N-CA 117.816 -1.554 . . . . 32.130000000000003 111.095 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -70.35 -38.37 74.82 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 104.738 -2.319 . . . . 41.850000000000001 104.738 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.01 -42.13 98.83 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 124.794 1.309 . . . . 33.810000000000002 110.679 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -53.93 52.01 Favored 'General case' 0 CA--C 1.476 -1.893 0 CA-C-N 116.377 -0.374 . . . . 33.350000000000001 110.778 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -50.66 -44.04 57.53 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 112.806 0.669 . . . . 44.030000000000001 112.806 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -61.01 -51.06 70.83 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.769 -1.173 . . . . 43.5 107.97 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -63.85 -42.28 97.6 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.768 -0.651 . . . . 30.809999999999999 110.176 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' LEU . . . . . . . . . . . . . 57.6 mt -46.38 -46.82 18.74 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-O 121.871 0.843 . . . . 29.670000000000002 113.192 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' THR . . . . . 0.722 ' OG1' ' NH2' ' D' ' 64' ' ' ARG . 21.4 m -59.91 -44.42 94.28 Favored 'General case' 0 C--O 1.196 -1.739 0 CA-C-O 118.659 -0.686 . . . . 32.659999999999997 110.138 177.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -57.06 -44.08 82.69 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.531 0.605 . . . . 31.16 112.034 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.93 -51.1 68.84 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-O 121.487 0.661 . . . . 22.82 111.144 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -50.39 -49.05 55.52 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.54 0.686 . . . . 40.409999999999997 110.972 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -57.61 -44.15 85.25 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.164 -0.925 . . . . 40.009999999999998 109.008 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' GLY . . . . . . . . . . . . . . . -45.32 -58.43 5.17 Favored Glycine 0 C--O 1.205 -1.69 0 CA-C-N 113.477 -1.692 . . . . 23.199999999999999 110.388 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -70.65 -28.78 65.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 115.091 1.515 . . . . 29.449999999999999 115.091 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -71.44 -39.5 70.99 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 119.169 -1.012 . . . . 45.380000000000003 109.616 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.49 -46.66 76.88 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.851 1.31 . . . . 59.909999999999997 110.033 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.18 -42.95 88.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.504 -1.295 . . . . 31.100000000000001 107.504 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -56.28 -46.26 79.81 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.572 0.953 . . . . 63.729999999999997 113.572 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -51.64 -62.83 1.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.878 -1.156 . . . . 48.189999999999998 107.878 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -46.76 -40.05 12.84 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 114.365 1.246 . . . . 46.100000000000001 114.365 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.72 -40.86 75.98 Favored 'General case' 0 C--O 1.2 -1.521 0 CA-C-O 121.281 0.563 . . . . 43.219999999999999 110.601 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -52.66 -51.84 58.39 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.164 0.507 . . . . 49.509999999999998 111.452 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -55.95 -68.61 0.19 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.329 1.061 . . . . 54.299999999999997 109.361 178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' CYS . . . . . . . . . . . . . 19.5 t -40.03 -39.92 0.96 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.902 -1.045 . . . . 69.230000000000004 112.389 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.14 -28.86 66.81 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.836 0.68 . . . . 78.230000000000004 112.836 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -50.27 12.03 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.837 -1.172 . . . . 111.54000000000001 107.837 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -45.73 -44.35 13.6 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.812 -0.631 . . . . 58.450000000000003 110.181 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -61.04 -61.53 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.594 -1.185 . . . . 57.240000000000002 109.934 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' MSE . . . . . . . . . . . . . 65.2 mmm -47.62 -39.85 18.03 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 116.148 -0.478 . . . . 113.53 110.41 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.55 -56.99 13.2 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.873 0.844 . . . . 61.07 112.498 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.38 -41.16 84.17 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 116.019 -0.537 . . . . 58.579999999999998 112.372 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' MSE . . . . . . . . . . . . . 6.5 mtt -63.65 -12.15 31.43 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.585 0.587 . . . . 106.34999999999999 112.585 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.45 -49.8 5.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.23 -0.656 . . . . 61.609999999999999 109.23 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' SER . . . . . 0.431 ' O ' ' N ' ' C' ' 105' ' ' GLU . 10.5 m -49.91 -65.64 0.53 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.661 0.743 . . . . 58.700000000000003 110.097 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' LEU . . . . . 0.41 ' C ' ' O ' ' C' ' 101' ' ' SER . 15.3 tp -32.69 -60.0 0.31 Allowed 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.701 -0.682 . . . . 62.520000000000003 111.448 174.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -58.2 -49.84 75.65 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.197 0.999 . . . . 83.870000000000005 112.075 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.92 -41.9 68.2 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 120.623 -0.431 . . . . 63.890000000000001 109.885 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLU . . . . . 0.431 ' N ' ' O ' ' C' ' 101' ' ' SER . 44.8 tp10 -68.02 -46.85 70.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.813 -0.63 . . . . 73.879999999999995 111.465 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -51.46 -39.68 57.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.055 -0.975 . . . . 66.769999999999996 112.644 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.77 70.15 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.305 0.854 . . . . 68.290000000000006 113.305 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -78.6 -58.68 3.12 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.123 -0.631 . . . . 85.989999999999995 109.411 174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . -41.46 -57.83 3.11 Favored Glycine 0 C--O 1.208 -1.507 0 N-CA-C 108.58 -1.808 . . . . 56.770000000000003 108.58 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -42.27 -55.87 3.16 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 123.939 0.896 . . . . 97.599999999999994 108.923 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -70.46 -55.8 8.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 113.717 -1.583 . . . . 91.239999999999995 111.554 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' LYS . . . . . . . . . . . . . 9.3 mptt -48.81 -59.67 3.38 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.87 -1.059 . . . . 74.340000000000003 111.749 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' VAL . . . . . . . . . . . . . 1.3 t -44.28 -46.32 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.29 0.636 . . . . 50.649999999999999 112.141 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.82 -50.79 72.03 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 107.779 -1.193 . . . . 95.319999999999993 107.779 -176.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -38.17 -70.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.693 1.197 . . . . 78.019999999999996 113.469 172.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.07 -37.9 78.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.338 -1.301 . . . . 50.979999999999997 111.975 -177.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -62.47 -24.88 67.69 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.433 -0.907 . . . . 69.709999999999994 112.441 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.45 -43.87 14.56 Favored Glycine 0 C--O 1.222 -0.626 0 N-CA-C 110.935 -0.866 . . . . 55.799999999999997 110.935 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -55.26 -43.72 74.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.947 -0.76 . . . . 61.289999999999999 108.947 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 1.4 mp -55.02 -50.66 61.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 CA-C-N 115.515 -0.766 . . . . 45.469999999999999 111.135 174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' THR . . . . . . . . . . . . . 65.0 m -64.2 -40.03 95.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.155 -1.018 . . . . 59.329999999999998 111.732 -172.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.79 -35.05 67.3 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.477 0.656 . . . . 63.469999999999999 111.103 -173.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 24.7 mt -62.7 -44.85 95.18 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.614 -1.175 . . . . 45.520000000000003 108.903 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.28 -39.19 75.18 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.324 -0.95 . . . . 52.5 113.201 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.63 -45.48 58.8 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.015 -0.993 . . . . 69.140000000000001 109.454 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -58.12 -40.0 80.13 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.885 -1.052 . . . . 57.600000000000001 109.766 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' LEU . . . . . . . . . . . . . 20.3 tp -59.83 -44.58 93.98 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 119.784 -0.766 . . . . 39.659999999999997 110.708 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.15 -46.44 87.17 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.851 -0.613 . . . . 56.25 111.902 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -50.93 -35.89 35.72 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 114.556 1.317 . . . . 66.379999999999995 114.556 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.59 -42.22 14.55 Favored 'General case' 0 CA--C 1.491 -1.298 0 N-CA-C 107.242 -1.392 . . . . 44.0 107.242 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 16.8 m -57.04 -30.71 64.46 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.247 -0.888 . . . . 43.359999999999999 110.843 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -63.95 0.96 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 114.817 -1.083 . . . . 52.009999999999998 109.756 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -50.22 -29.27 9.09 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.061 -0.972 . . . . 60.740000000000002 110.732 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' VAL . . . . . . . . . . . . . 5.4 t -65.26 -57.31 11.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.508 -0.923 . . . . 44.289999999999999 108.508 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -39.14 -50.41 1.88 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 125.658 1.849 . . . . 57.539999999999999 115.702 172.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' ARG . . . . . . . . . . . . . 59.2 ttp85 -47.48 -45.68 26.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.238 -1.347 . . . . 83.010000000000005 108.005 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 18.7 mt -86.75 -40.66 14.8 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 114.036 1.125 . . . . 47.439999999999998 114.036 -167.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -53.1 -34.21 55.65 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 117.807 -1.557 . . . . 59.619999999999997 109.002 170.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 32.2 mtm-85 -63.54 -66.05 0.6 Allowed 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.028 -0.73 . . . . 69.709999999999994 109.028 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -41.48 -44.75 3.01 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 113.383 0.883 . . . . 65.439999999999998 113.383 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.43 -57.99 10.57 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.574 0.702 . . . . 66.099999999999994 112.152 -175.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -56.89 -47.74 79.78 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-N 114.126 -1.397 . . . . 72.849999999999994 111.053 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.7 -61.47 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 113.994 -1.457 . . . . 57.590000000000003 109.796 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.29 -37.63 78.16 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.365 -0.534 . . . . 48.969999999999999 112.314 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' SER . . . . . . . . . . . . . 3.0 p -68.13 -27.99 66.93 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 121.722 0.772 . . . . 46.020000000000003 111.348 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.85 -50.08 35.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 CA-C-O 122.421 1.105 . . . . 59.5 108.904 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -48.37 -38.72 20.08 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.862 -0.735 . . . . 73.469999999999999 110.468 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' ILE . . . . . . . . . . . . . 47.0 mt -68.11 -45.16 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 CA-C-O 121.607 0.718 . . . . 49.329999999999998 112.106 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' ALA . . . . . . . . . . . . . . . -51.28 -54.21 28.17 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.058 -0.973 . . . . 57.479999999999997 110.798 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -45.27 -55.41 5.92 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.974 1.101 . . . . 73.819999999999993 113.974 174.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.968 0 CA-C-N 115.021 -0.991 . . . . 81.400000000000006 111.547 -166.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.514 2.726 0 N-CA-C 113.099 0.777 . . . . 67.629999999999995 113.099 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -32.67 74.5 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 115.097 -0.956 . . . . 100.62 113.006 170.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.94 90.46 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 113.278 0.844 . . . . 62.859999999999999 113.278 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' CYS . . . . . . . . . . . . . 50.9 m -58.73 -53.02 63.04 Favored 'General case' 0 C--O 1.2 -1.514 0 O-C-N 120.973 -1.079 . . . . 47.789999999999999 110.409 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -54.42 -52.49 61.61 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 113.641 -1.618 . . . . 113.25 108.685 -174.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.7 -43.18 85.07 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.661 -0.7 . . . . 60.020000000000003 111.884 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.12 98.02 Favored Glycine 0 C--O 1.206 -1.595 0 N-CA-C 110.232 -1.147 . . . . 39.899999999999999 110.232 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.33 -39.99 89.6 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 107.109 -1.441 . . . . 30.82 107.109 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' ARG . . . . . 0.486 ' NH2' ' OE2' ' A' ' 73' ' ' GLU . 3.0 ttp180 -60.36 -52.68 64.22 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.43 -0.908 . . . . 43.420000000000002 109.097 -177.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.0 -39.04 68.63 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 119.786 -0.766 . . . . 37.170000000000002 111.084 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.81 -50.9 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 119.2 -1.0 . . . . 34.840000000000003 110.402 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' MSE . . . . . . . . . . . . . 28.0 mmt -55.33 -38.75 69.13 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.507 -0.923 . . . . 65.959999999999994 108.507 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -67.0 -40.72 87.39 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.607 -1.237 . . . . 47.630000000000003 111.25 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' CYS . . . . . . . . . . . . . 81.5 m -58.86 -34.9 72.11 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 120.41 -1.431 . . . . 36.93 109.846 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' ARG . . . . . 0.722 ' NH2' ' OG1' ' C' ' 75' ' ' THR . 25.2 ttm-85 -63.91 -50.17 69.77 Favored 'General case' 0 C--N 1.278 -2.519 0 CA-C-N 114.258 -1.337 . . . . 45.32 107.58 -177.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -56.87 -42.68 80.23 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-O 122.175 0.988 . . . . 30.210000000000001 113.029 178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 83.7 t -70.37 -46.55 70.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 112.949 -1.932 . . . . 31.670000000000002 110.765 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' THR . . . . . . . . . . . . . 98.2 m -60.09 -34.14 73.06 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.703 -1.142 . . . . 30.129999999999999 112.156 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -62.27 -34.14 75.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 116.737 -1.985 . . . . 33.93 111.258 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 14.7 tp -73.47 -40.77 63.89 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.531 1.158 . . . . 33.009999999999998 107.975 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' LEU . . . . . . . . . . . . . 8.5 tp -50.9 -52.68 39.6 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 114.243 -1.344 . . . . 32.130000000000003 112.188 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -53.19 -43.4 67.13 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.843 1.423 . . . . 36.810000000000002 114.843 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -66.3 -39.28 89.22 Favored 'General case' 0 C--O 1.26 1.611 0 C-N-CA 119.818 -0.753 . . . . 35.899999999999999 112.295 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -73.0 -36.37 67.03 Favored 'General case' 0 C--O 1.205 -1.249 0 C-N-CA 118.626 -1.23 . . . . 33.810000000000002 110.461 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' LEU . . . . . . . . . . . . . 49.9 mt -59.85 -38.66 82.72 Favored 'General case' 0 C--O 1.254 1.308 0 N-CA-C 113.102 0.778 . . . . 31.82 113.102 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 54.4 m -63.61 -41.14 98.33 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 122.684 1.23 . . . . 34.32 108.09 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -65.13 -34.28 78.03 Favored 'General case' 0 C--O 1.193 -1.908 0 CA-C-N 114.653 -1.158 . . . . 34.920000000000002 112.718 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.07 84.08 Favored 'General case' 0 C--O 1.19 -2.071 0 O-C-N 119.935 -1.728 . . . . 27.43 113.04 170.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -50.54 -42.05 54.73 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 107.87 -1.159 . . . . 45.0 107.87 173.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -61.93 -46.46 89.23 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.862 0.69 . . . . 43.439999999999998 112.862 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' GLY . . . . . . . . . . . . . . . -49.64 -51.57 27.64 Favored Glycine 0 N--CA 1.479 1.549 0 CA-C-N 115.786 -0.643 . . . . 27.370000000000001 112.336 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -65.47 -28.59 69.32 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 112.676 0.621 . . . . 36.18 112.676 -173.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -80.72 -43.05 20.88 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.197 -1.001 . . . . 47.270000000000003 110.092 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.58 -35.45 72.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 118.753 -1.179 . . . . 38.539999999999999 109.515 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.2 -49.78 40.87 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 O-C-N 121.419 -0.8 . . . . 34.039999999999999 112.776 -176.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -47.09 -37.31 9.42 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.77 1.228 . . . . 54.399999999999999 112.674 169.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.01 83.92 Favored 'General case' 0 C--O 1.198 -1.609 0 N-CA-C 108.619 -0.882 . . . . 44.990000000000002 108.619 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.55 -40.62 25.57 Favored 'General case' 0 C--O 1.21 -1.016 0 O-C-N 124.113 0.883 . . . . 74.590000000000003 113.208 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.65 -28.06 8.16 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 106.737 -1.579 . . . . 48.939999999999998 106.737 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.27 9.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 118.325 -1.35 . . . . 50.880000000000003 109.879 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' THR . . . . . . . . . . . . . 60.6 m -46.64 -47.91 20.05 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 104.797 -2.297 . . . . 53.609999999999999 104.797 176.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' CYS . . . . . . . . . . . . . 57.5 m -70.01 -50.22 43.67 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.962 1.467 . . . . 60.060000000000002 114.962 -172.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -54.33 -56.44 18.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.783 0.801 . . . . 79.069999999999993 108.918 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -40.24 -58.15 1.56 Allowed 'General case' 0 C--O 1.212 -0.879 0 CA-C-N 114.967 -1.015 . . . . 65.200000000000003 109.998 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 24.0 m -51.67 -63.89 0.99 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 119.781 -0.767 . . . . 62.899999999999999 109.325 -174.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 1.8 t -39.99 -55.77 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.638 0.775 . . . . 63.649999999999999 112.187 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -51.66 -47.13 63.92 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.083 -0.962 . . . . 116.78 110.414 -179.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.24 -35.5 67.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.248 0.619 . . . . 67.609999999999999 111.956 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.87 -50.07 12.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.251 -0.886 . . . . 74.760000000000005 112.179 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' MSE . . . . . . . . . . . . . 91.6 mtp -45.72 -46.13 14.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.643 -0.708 . . . . 120.39 109.322 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.21 98.78 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 114.811 -1.086 . . . . 76.989999999999995 110.38 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -35.55 81.5 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 122.181 0.991 . . . . 66.170000000000002 112.212 179.478 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -68.14 -61.9 1.64 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.134 -0.939 . . . . 70.870000000000005 110.109 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -44.2 -35.21 2.14 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 115.106 1.521 . . . . 91.689999999999998 115.106 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.44 -26.8 46.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.054 -0.721 . . . . 76.870000000000005 109.054 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -69.81 -35.3 74.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.35 -1.295 . . . . 77.329999999999998 111.125 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -66.95 -35.35 79.78 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.801 -0.636 . . . . 97.400000000000006 110.552 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.98 58.86 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 114.328 -1.305 . . . . 85.450000000000003 111.454 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -83.08 -33.03 26.48 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.353 1.033 . . . . 85.640000000000001 108.46 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.15 -52.43 5.68 Favored Glycine 0 C--O 1.21 -1.373 0 CA-C-N 115.293 -0.867 . . . . 72.620000000000005 113.916 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.99 -7.6 59.62 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.116 0.413 . . . . 98.090000000000003 112.116 -175.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' LYS . . . . . . . . . . . . . 44.1 tttt -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.57 -0.741 . . . . 109.27 110.157 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -69.37 -54.76 12.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.831 -0.803 . . . . 92.840000000000003 108.831 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.91 -52.92 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.359 1.064 . . . . 69.469999999999999 112.256 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -88.38 -1.96 58.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.855 -1.066 . . . . 118.89 110.866 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.23 -29.37 23.2 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.717 -1.216 . . . . 106.69 107.717 167.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.02 -12.01 29.54 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.213 -1.358 . . . . 96.799999999999997 113.522 178.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -90.76 -27.56 18.84 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 121.699 0.761 . . . . 84.989999999999995 111.954 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.62 9.78 41.4 Favored Glycine 0 N--CA 1.471 1.003 0 N-CA-C 109.288 -1.525 . . . . 85.5 109.288 168.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.4 -34.4 6.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 113.945 -1.127 . . . . 84.959999999999994 109.326 169.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' ILE . . . . . . . . . . . . . 36.3 mm -54.91 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.836 0 N-CA-C 108.082 -1.081 . . . . 65.849999999999994 108.082 171.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' THR . . . . . . . . . . . . . 55.4 p -54.99 -31.4 60.94 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.621 -1.172 . . . . 79.969999999999999 110.151 -170.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -16.68 61.26 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.629 0.974 . . . . 84.780000000000001 113.629 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.39 -39.91 12.39 Favored 'General case' 0 C--O 1.216 -0.68 0 N-CA-C 108.26 -1.015 . . . . 70.450000000000003 108.26 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -51.85 -53.28 42.23 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.944 1.831 . . . . 66.480000000000004 115.944 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -51.19 -43.89 61.43 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.987 -0.551 . . . . 87.980000000000004 110.869 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -60.8 -41.32 95.43 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.551 0.574 . . . . 72.879999999999995 112.551 176.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' LEU . . . . . . . . . . . . . 17.2 tp -61.29 -62.39 1.87 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.469 -0.787 . . . . 57.07 109.617 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -43.26 -39.26 2.93 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 112.939 0.718 . . . . 84.239999999999995 112.939 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.06 -44.61 12.87 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.797 -0.638 . . . . 82.819999999999993 111.361 -170.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.1 -27.31 67.24 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.595 -0.73 . . . . 60.990000000000002 110.192 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 12.1 p -91.7 -1.66 57.33 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 117.301 -1.76 . . . . 60.700000000000003 112.635 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.47 37.42 Favored 'General case' 0 CA--C 1.489 -1.402 0 N-CA-C 105.558 -2.016 . . . . 71.299999999999997 105.558 168.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.38 -29.83 68.63 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.993 -1.458 . . . . 74.079999999999998 111.596 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' VAL . . . . . . . . . . . . . 7.1 t -67.69 -47.74 78.81 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.685 -0.806 . . . . 58.200000000000003 109.307 174.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -59.37 -36.47 75.82 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 114.299 1.222 . . . . 85.159999999999997 114.299 174.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -59.25 -61.4 2.66 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 108.282 -1.007 . . . . 85.099999999999994 108.282 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.31 -34.93 76.05 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.33 -1.759 . . . . 62.950000000000003 113.259 -172.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 10.3 ttp85 -63.31 -59.53 4.59 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 120.967 0.413 . . . . 95.959999999999994 111.599 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' ARG . . . . . . . . . . . . . 36.4 mtm-85 -48.79 -43.36 37.98 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.503 -0.748 . . . . 97.909999999999997 110.731 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.93 -27.9 62.13 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.407 0.891 . . . . 90.019999999999996 113.407 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -67.29 -45.38 76.74 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.595 -0.442 . . . . 73.159999999999997 110.932 170.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -64.94 -32.93 74.88 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 116.036 -0.529 . . . . 77.640000000000001 111.848 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' VAL . . . . . . . . . . . . . 5.1 t -60.16 -63.22 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.467 -1.309 . . . . 78.069999999999993 107.467 173.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 16.9 mt -52.2 -40.19 61.22 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 115.372 -0.831 . . . . 64.650000000000006 112.718 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' SER . . . . . . . . . . . . . 2.9 m -59.54 -30.23 68.46 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.063 0.458 . . . . 63.969999999999999 111.726 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -89.72 -31.94 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 CA-C-N 114.86 -1.064 . . . . 79.840000000000003 110.82 -172.466 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 147' ' ' ARG . . . . . . . . . . . . . 50.2 mtp180 -61.99 -28.52 69.62 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 115.906 -0.588 . . . . 87.939999999999998 112.044 165.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 148' ' ' ILE . . . . . . . . . . . . . 1.4 mm -69.24 -59.11 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 109.463 -0.569 . . . . 73.379999999999995 109.463 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.65 -24.54 63.95 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 113.961 1.097 . . . . 81.650000000000006 113.961 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 N--CA 1.495 1.821 0 C-N-CA 123.715 0.806 . . . . 100.45 111.45 177.139 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . 0.431 ' O ' ' CD ' ' B' ' 64' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . 0.431 ' O ' ' CG ' ' A' ' 76' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' HOH . . . . . 0.857 ' O ' ' CD2' ' B' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 113.078 0.77 . . . . 114.09 113.078 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -55.03 -87.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.287 -1.005 . . . . 102.93 108.287 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.3 m -64.15 -9.88 19.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 117.096 2.258 . . . . 90.35 117.096 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.43 -26.87 65.55 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 115.013 1.486 . . . . 114.68 115.013 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.77 -41.48 26.49 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.517 0.562 . . . . 69.01 112.517 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' B' ' 84' ' ' VAL . 0.8 OUTLIER -59.81 -40.46 88.5 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.276 0.843 . . . . 49.04 113.276 170.002 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.34 -58.85 6.16 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 124.296 1.038 . . . . 105.78 110.012 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -57.89 -41.18 82.0 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.449 -0.796 . . . . 71.58 111.536 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.02 -40.88 92.02 Favored Glycine 0 C--O 1.2 -2.022 0 CA-C-N 114.559 -1.201 . . . . 41.65 112.051 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD22 ' HE2' ' A' ' 61' ' ' MSE . 11.3 mt -69.73 -39.28 76.9 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.423 -1.045 . . . . 33.06 112.87 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -65.3 -45.73 83.23 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.38 0.61 . . . . 81.55 110.917 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.49 -40.09 65.09 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 107.867 -1.16 . . . . 39.15 107.867 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -68.13 -41.86 84.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 C-N-CA 119.57 -0.852 . . . . 30.34 109.818 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' MSE . . . . . 0.439 ' HE2' HD22 ' A' ' 57' ' ' LEU . 11.0 mmt -64.09 -39.96 95.19 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 114.05 -1.432 . . . . 71.98 111.775 175.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -64.97 -37.15 86.7 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 107.381 -1.34 . . . . 52.23 107.381 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 67' ' ' THR . 68.5 m -60.78 -43.02 98.61 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.797 -1.161 . . . . 31.85 110.014 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 12.6 ttm-85 -62.04 -43.46 98.79 Favored 'General case' 0 C--N 1.29 -2.007 0 C-N-CA 120.087 -0.645 . . . . 44.91 109.754 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -66.1 -41.31 90.81 Favored 'General case' 0 C--O 1.2 -1.509 0 C-N-CA 118.521 -1.272 . . . . 40.98 112.703 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.5 t -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-N 114.997 -1.001 . . . . 35.82 111.067 176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 63' ' ' CYS 0.285 2.3 p -67.84 -31.19 70.86 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 116.295 -2.162 . . . . 30.95 113.879 -179.822 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -53.91 -44.18 70.33 Favored 'General case' 0 N--CA 1.512 2.642 0 CA-C-N 119.501 1.046 . . . . 37.78 110.265 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.61 -40.68 95.7 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-O 122.874 1.321 . . . . 35.89 111.807 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 tp -54.32 -57.22 12.09 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.696 -1.138 . . . . 25.16 111.936 170.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -48.05 -42.61 28.91 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.293 0.37 . . . . 30.37 110.498 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.07 -47.86 81.12 Favored 'General case' 0 C--O 1.245 0.837 0 C-N-CA 119.34 -0.944 . . . . 36.53 109.519 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . 0.451 ' OE2' ' NH2' ' D' ' 58' ' ' ARG . 45.5 mm-40 -69.91 -31.46 69.26 Favored 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 116.513 -2.075 . . . . 33.35 111.824 -174.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 23.3 mt -64.85 -38.18 90.1 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 120.754 -1.216 . . . . 23.69 112.694 173.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.6 m -58.15 -45.1 88.02 Favored 'General case' 0 C--O 1.197 -1.69 0 N-CA-C 108.186 -1.042 . . . . 29.0 108.186 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 12' ' ' HOH . 3.4 tp10 -61.28 -46.02 92.07 Favored 'General case' 0 CA--C 1.56 1.355 0 N-CA-C 114.235 1.198 . . . . 45.51 114.235 174.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.63 -35.62 61.16 Favored 'General case' 0 N--CA 1.523 3.224 0 O-C-N 120.993 -1.067 . . . . 24.92 113.091 169.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -71.76 -40.09 69.54 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.357 -0.838 . . . . 55.13 109.841 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' A' ' 80' ' ' GLY . 32.7 tttt -54.92 -57.53 11.25 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 104.455 -2.424 . . . . 53.16 104.455 173.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 79' ' ' LYS . . . -31.84 -59.12 0.34 Allowed Glycine 0 C--N 1.291 -1.953 0 CA-C-N 115.417 -0.81 . . . . 22.74 113.535 176.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -71.45 -37.7 71.38 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 118.595 1.198 . . . . 32.35 113.403 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -55.51 -53.39 56.9 Favored 'General case' 0 C--O 1.199 -1.572 0 N-CA-C 104.889 -2.263 . . . . 43.72 104.889 175.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -63.82 -38.99 93.15 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 120.111 -1.618 . . . . 30.43 114.112 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . 0.823 HG11 HG11 ' C' ' 84' ' ' VAL . 2.2 t -58.0 -45.44 88.0 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 O-C-N 120.643 -1.286 . . . . 28.41 110.442 -179.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -51.84 -43.38 63.17 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.299 0.852 . . . . 59.13 113.299 167.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -55.65 -60.5 3.36 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.658 -1.608 . . . . 35.75 106.658 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -54.68 -39.48 68.16 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.364 1.616 . . . . 35.55 115.364 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' ' C ' ' A' ' 89' ' ' ALA . . . -60.74 -43.32 98.08 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.776 -1.194 . . . . 35.11 107.776 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . 0.445 ' C ' ' O ' ' A' ' 88' ' ' ALA . . . -56.58 -53.18 60.57 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 104.51 -2.404 . . . . 40.74 104.51 -173.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.4 m -51.98 -48.31 64.44 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.906 1.282 . . . . 35.48 111.999 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' C' ' 91' ' ' CYS . 97.7 m -63.44 -41.9 98.66 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 114.352 1.242 . . . . 52.87 114.352 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.8 -37.59 84.96 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.934 0.873 . . . . 65.95 110.999 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -64.46 -48.28 75.86 Favored 'General case' 0 C--O 1.21 -1.012 0 N-CA-C 107.848 -1.167 . . . . 60.73 107.848 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.2 m -52.13 -49.3 63.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 119.531 -0.867 . . . . 47.2 108.951 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -51.35 70.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 122.168 -0.332 . . . . 51.62 110.934 -177.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' MSE . . . . . . . . . . . . . 25.0 mtp -61.49 -36.12 79.6 Favored 'General case' 0 C--O 1.214 -0.81 0 O-C-N 124.608 1.193 . . . . 136.81 110.536 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -73.56 -41.74 62.57 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.398 -0.921 . . . . 58.74 109.348 -178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.96 -40.99 95.49 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.166 -0.47 . . . . 51.45 111.188 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' MSE . . . . . . . . . . . . . 10.7 mtp -68.8 -41.95 77.97 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.429 0.633 . . . . 106.19 112.134 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -50.03 -58.95 4.42 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.517 -1.29 . . . . 54.91 107.517 172.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . 0.273 0.1 OUTLIER -72.79 -13.54 61.33 Favored 'General case' 0 C--O 1.206 -1.209 0 C-N-CA 119.759 -0.777 . . . . 51.52 111.803 -169.736 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.49 -54.27 9.74 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.158 -0.682 . . . . 57.2 109.158 166.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -49.18 -52.46 26.51 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 115.613 -0.721 . . . . 69.56 111.221 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' A' ' 105' ' ' GLU . . . -46.72 -63.94 0.89 Allowed 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.362 -0.977 . . . . 50.77 108.362 174.102 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 104' ' ' ALA . 12.6 tp10 -45.47 -51.09 12.07 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.997 -1.081 . . . . 61.17 111.626 -175.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -52.23 -45.93 65.5 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.099 1.148 . . . . 75.2 114.099 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.91 -54.23 14.37 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.861 0.864 . . . . 66.87 111.235 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.3 mm-40 -54.96 -39.72 69.23 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 122.119 0.961 . . . . 85.94 108.412 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -65.69 -53.6 30.46 Favored Glycine 0 N--CA 1.476 1.349 0 CA-C-N 114.14 -1.391 . . . . 56.01 113.279 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -8.55 57.57 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.999 -0.68 . . . . 84.74 109.839 -175.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -77.08 -43.72 33.26 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 114.93 -1.032 . . . . 82.01 109.523 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.2 -46.49 64.45 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 120.093 -0.643 . . . . 74.41 109.82 -178.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 42.2 t -44.03 -52.46 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.86 -0.336 . . . . 49.87 110.986 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.05 -34.25 77.65 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.503 0.557 . . . . 77.77 112.503 -174.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.94 -34.83 77.34 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.838 -0.619 . . . . 84.4 111.103 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.4 mt -89.54 -27.87 19.99 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.981 -1.008 . . . . 48.02 111.675 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -70.33 -34.19 72.38 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 119.278 -0.969 . . . . 71.2 109.697 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . 0.402 ' O ' ' HB ' ' A' ' 121' ' ' THR . . . -57.66 -56.39 25.39 Favored Glycine 0 C--N 1.311 -0.811 0 N-CA-C 108.542 -1.823 . . . . 57.48 108.542 173.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -29.84 71.12 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.399 0.889 . . . . 63.04 113.399 -174.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . 0.661 HG13 HD12 ' C' ' 120' ' ' ILE . 1.2 mt -62.05 -45.04 99.61 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.948 -1.13 . . . . 43.21 107.948 175.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' THR . . . . . 0.402 ' HB ' ' O ' ' A' ' 118' ' ' GLY . 0.9 OUTLIER -50.62 -59.01 4.49 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.068 -1.423 . . . . 55.99 111.789 -179.229 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 p -61.76 -41.04 97.16 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.475 -0.935 . . . . 56.98 108.475 -176.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.3 mt -63.24 -32.13 73.46 Favored 'General case' 0 C--O 1.196 -1.727 0 C-N-CA 120.256 -0.578 . . . . 45.65 111.978 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . 0.448 ' O ' ' HG3' ' A' ' 128' ' ' GLN . 93.8 m-20 -66.97 -44.3 80.84 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.242 1.02 . . . . 48.59 108.919 177.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 64.7 m170 -58.85 -47.16 85.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.479 -1.237 . . . . 62.01 108.294 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -62.78 -32.33 73.47 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-N 114.719 -1.128 . . . . 53.52 110.257 -174.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 17.0 tp -75.77 -31.63 59.58 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.774 0.797 . . . . 37.72 110.479 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 124' ' ' ASN . 88.8 mt-30 -67.63 -34.75 77.6 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 118.665 -1.214 . . . . 57.76 109.829 173.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -72.08 -50.42 28.39 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 116.364 -0.38 . . . . 51.18 111.675 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -44.1 81.53 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.445 -0.798 . . . . 36.23 112.853 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 38.2 m -67.95 -33.59 74.96 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 118.948 -1.101 . . . . 37.92 111.674 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.04 -45.63 84.62 Favored 'General case' 0 C--O 1.209 -1.072 0 N-CA-C 106.386 -1.709 . . . . 43.49 106.386 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.77 -33.24 75.23 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.695 -1.138 . . . . 60.68 111.399 -175.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 48.5 t -65.97 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 CA-C-N 115.33 -0.85 . . . . 42.9 112.734 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -80.46 -29.31 37.48 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 107.943 -1.132 . . . . 65.45 107.943 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ARG . . . . . 0.433 HH21 HD21 ' A' ' 137' ' ' LEU . 1.2 ttp180 -60.64 -57.17 13.86 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.16 -1.422 . . . . 66.06 107.16 175.625 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . 0.433 HD21 HH21 ' A' ' 136' ' ' ARG . 26.4 mt -66.12 -26.81 67.62 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.534 0.939 . . . . 43.65 113.534 -177.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 34.6 ttm105 -65.73 -46.25 79.62 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.133 -1.427 . . . . 62.25 112.687 170.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' A' ' 142' ' ' GLN . 92.6 mtm-85 -60.39 -58.73 7.25 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 118.59 -1.244 . . . . 69.12 108.316 178.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -46.37 -41.6 13.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.57 0.7 . . . . 61.06 111.633 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.84 -53.55 56.9 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.998 -1.001 . . . . 57.99 110.206 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 139' ' ' ARG . 3.2 pt20 -62.07 -37.36 84.71 Favored 'General case' 0 C--O 1.207 -1.183 0 N-CA-C 108.296 -1.002 . . . . 65.25 108.296 -171.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 13.8 t -65.45 -30.83 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 112.72 0.637 . . . . 49.36 112.72 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 75.8 mt -82.68 -41.54 19.24 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 119.914 -0.714 . . . . 48.46 110.288 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 3.3 m -46.84 -51.23 17.05 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.351 -0.84 . . . . 53.53 110.615 168.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.64 -47.14 94.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 113.047 0.758 . . . . 56.21 113.047 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -55.8 -16.05 3.98 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 114.827 1.418 . . . . 65.09 114.827 171.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 20.4 mt -89.61 -42.56 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 121.374 0.607 . . . . 71.94 111.548 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.89 -46.18 90.16 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.111 0.782 . . . . 92.26 113.111 170.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.43 4.49 12.99 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.269 0.557 . . . . 92.17 110.371 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 34.8 tttt -82.56 -48.06 11.42 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.637 -0.71 . . . . 131.11 111.243 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 5.4 mttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.387 0.613 . . . . 93.13 111.231 174.815 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.512 2.635 0 N-CA-C 112.168 0.432 . . . . 87.45 112.168 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.85 26.34 4.14 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.444 1.116 . . . . 106.41 110.484 167.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -91.06 -43.92 9.62 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 114.504 -1.225 . . . . 80.08 111.578 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -53.13 -35.88 60.18 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.264 -1.335 . . . . 75.86 109.938 165.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -72.25 -46.23 56.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.937 0.717 . . . . 117.84 112.937 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.55 -42.23 92.14 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.367 -0.533 . . . . 66.04 111.293 173.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 6.3 m -55.65 -50.93 68.89 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.028 -1.069 . . . . 49.01 109.133 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -45.43 -56.98 4.42 Favored 'General case' 0 C--O 1.2 -1.543 0 CA-C-N 114.776 -1.102 . . . . 72.23 113.075 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -57.26 -50.72 71.99 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.611 -0.681 . . . . 73.92 109.865 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -40.77 -54.26 3.55 Favored Glycine 0 N--CA 1.487 2.037 0 O-C-N 125.431 1.707 . . . . 44.36 112.068 170.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.28 -36.47 84.2 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 113.574 0.953 . . . . 38.24 113.574 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -57.06 -52.91 63.38 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 112.697 0.628 . . . . 89.84 112.697 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.41 -40.72 78.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.125 0.964 . . . . 44.5 111.502 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.78 -41.84 92.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 C-N-CA 118.797 -1.161 . . . . 34.99 110.805 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' MSE . . . . . . . . . . . . . 23.9 ttp -68.37 -40.31 81.46 Favored 'General case' 0 C--O 1.206 -1.23 0 N-CA-C 113.056 0.761 . . . . 80.46 113.056 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -55.36 -39.58 70.23 Favored 'General case' 0 C--O 1.209 -1.061 0 CA-C-O 121.265 0.555 . . . . 60.48 110.486 169.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.48 -42.84 91.76 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.133 -0.627 . . . . 35.85 111.292 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ARG . . . . . 0.811 ' HD3' ' O ' ' A' ' 11' ' ' HOH . 73.1 mtm180 -61.06 -52.87 63.11 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.557 -0.747 . . . . 46.24 112.631 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASN . . . . . 0.732 ' O ' ' HB3' ' B' ' 68' ' ' HIS . 79.8 m-20 -52.13 -45.13 64.85 Favored 'General case' 0 C--O 1.198 -1.613 0 C-N-CA 119.385 -0.926 . . . . 54.2 112.184 176.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . 0.647 HG13 HG13 ' C' ' 66' ' ' VAL . 9.0 t -63.68 -48.14 87.99 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.969 0 CA-C-N 114.842 -1.072 . . . . 43.81 112.732 -176.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 37.0 p -57.37 -22.69 44.25 Favored 'General case' 0 C--O 1.201 -1.448 0 C-N-CA 119.531 -0.868 . . . . 36.35 109.015 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . 0.732 ' HB3' ' O ' ' B' ' 65' ' ' ASN . 23.2 t-80 -60.51 -56.0 26.7 Favored 'General case' 0 C--O 1.193 -1.877 0 CA-C-N 114.926 -1.034 . . . . 68.81 110.367 175.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . 0.893 HD23 ' O ' ' B' ' 15' ' ' HOH . 6.8 mt -57.03 -43.51 81.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 122.005 0.907 . . . . 58.77 111.062 175.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 5.6 tp -50.99 -50.68 57.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.397 -1.274 . . . . 40.05 110.261 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLN . . . . . 0.479 ' OE1' ' HA ' ' B' ' 71' ' ' GLN . 11.8 mm-40 -53.19 -50.11 65.32 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.786 -1.552 . . . . 69.07 110.161 178.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . 0.26 11.4 pt20 -71.76 -41.53 68.29 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.839 1.052 . . . . 71.08 113.839 -175.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -62.11 -31.32 71.77 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.643 -1.223 . . . . 56.15 108.159 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 25.8 mt -60.12 -37.54 80.35 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.691 0.758 . . . . 36.55 111.173 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 16.1 m -65.55 -38.57 89.97 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.047 -0.979 . . . . 49.06 109.563 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -66.04 -42.25 89.8 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 120.236 -0.586 . . . . 49.34 111.652 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.58 77.24 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 107.421 -1.326 . . . . 34.04 107.421 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.1 -39.86 93.73 Favored 'General case' 0 C--O 1.208 -1.1 0 O-C-N 121.9 -0.5 . . . . 57.65 110.834 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' B' ' 16' ' ' HOH . 23.1 mttt -60.04 -41.67 92.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.75 1.262 . . . . 61.44 108.698 179.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -55.63 -53.01 44.43 Favored Glycine 0 C--N 1.303 -1.257 0 CA-C-N 113.723 -1.581 . . . . 34.59 113.202 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -65.25 -31.21 72.25 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.891 -0.723 . . . . 45.02 111.067 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -74.78 -39.28 61.85 Favored 'General case' 0 C--O 1.209 -1.063 0 N-CA-C 109.021 -0.733 . . . . 62.71 109.021 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.05 -37.53 86.08 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.775 0.798 . . . . 49.84 110.688 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 53' ' ' CYS . 1.5 t -63.33 -34.75 69.0 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 O-C-N 121.641 -0.662 . . . . 47.52 110.211 177.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -69.14 -46.86 66.56 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.552 0.691 . . . . 83.54 109.323 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.56 -50.89 66.87 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.421 -1.263 . . . . 62.92 108.31 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.49 -40.55 87.37 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.937 0.717 . . . . 72.65 112.937 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.57 62.92 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 121.35 0.595 . . . . 66.95 109.509 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -52.97 31.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.05 -0.977 . . . . 78.27 109.042 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 93' ' ' HIS . 3.1 m -49.49 -40.37 37.19 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 114.396 -1.274 . . . . 70.27 110.768 171.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 14.0 t -70.89 -24.13 62.42 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.758 -1.11 . . . . 83.83 113.843 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -69.59 -59.08 3.2 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.661 -1.237 . . . . 118.01 107.661 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' B' ' 90' ' ' THR . 21.0 t60 -34.22 -64.73 0.23 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.085 -1.871 . . . . 117.41 109.161 171.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 16.4 m -51.61 -40.72 60.38 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 115.632 1.716 . . . . 81.24 115.632 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.62 -35.84 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 N-CA-C 116.196 1.924 . . . . 99.12 116.196 -174.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' MSE . . . . . . . . . . . . . 20.3 mtm -69.93 -35.83 74.85 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.247 0.546 . . . . 161.21 110.108 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.14 -37.09 69.5 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.409 -1.269 . . . . 110.27 111.06 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' B' ' 98' ' ' LEU . 3.3 tp -59.81 -60.17 4.26 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.597 0.713 . . . . 97.34 110.422 179.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' MSE . . . . . . . . . . . . . 10.9 mtp -53.32 -46.65 69.54 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.326 -0.852 . . . . 148.98 110.265 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.2 72.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 115.344 -0.844 . . . . 123.1 110.118 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -49.02 73.36 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.389 -0.823 . . . . 103.8 110.693 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . 0.857 HD12 HD12 ' D' ' 102' ' ' LEU . 31.4 tp -55.78 -51.64 66.72 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.131 -0.941 . . . . 97.9 110.221 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -53.47 -50.51 65.17 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 115.239 -0.891 . . . . 124.4 110.812 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.24 56.44 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.524 -0.762 . . . . 111.71 110.411 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' B' ' 106' ' ' LYS . 0.0 OUTLIER -53.03 -50.85 63.41 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.301 -0.863 . . . . 108.92 110.419 179.696 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LYS . . . . . 1.247 ' HD3' ' N ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -53.73 -54.53 36.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.97 0.89 . . . . 139.91 110.677 179.831 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . 1.247 ' N ' ' HD3' ' B' ' 106' ' ' LYS . . . -52.07 -50.11 62.19 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.032 -0.986 . . . . 116.19 110.456 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -54.64 -57.63 10.69 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.394 -0.821 . . . . 134.28 110.632 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLY . . . . . 1.154 ' O ' HG23 ' B' ' 113' ' ' VAL . . . -50.97 -43.89 49.72 Favored Glycine 0 N--CA 1.471 1.009 0 CA-C-N 115.152 -0.931 . . . . 86.55 111.854 179.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -62.17 -57.49 11.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.354 0.597 . . . . 130.23 111.17 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.16 -21.87 25.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.398 -0.819 . . . . 133.68 110.621 -179.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -107.31 33.86 3.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 116.44 111.569 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' VAL . . . . . 1.154 HG23 ' O ' ' B' ' 109' ' ' GLY . 62.0 t -135.04 -49.19 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.083 -1.451 . . . . 87.8 107.083 -179.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.21 -21.11 65.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.216 -0.902 . . . . 127.64 110.518 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -69.24 -51.14 40.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.571 -0.74 . . . . 111.19 109.24 166.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' B' ' 119' ' ' GLU . 2.3 mt -60.8 -40.9 94.41 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.991 1.108 . . . . 75.29 113.991 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . 0.269 12.2 pt-20 -83.88 -2.05 55.68 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.179 -1.408 . . . . 104.43 113.707 -175.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -80.86 -35.31 25.14 Favored Glycine 0 N--CA 1.474 1.173 0 N-CA-C 107.904 -2.078 . . . . 85.85 107.904 168.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 116' ' ' LEU . 4.9 mt-10 -58.9 -53.28 60.13 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 113.925 -1.137 . . . . 90.88 109.613 169.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 mt -55.45 -47.59 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 112.672 0.619 . . . . 64.84 112.672 -174.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 71.0 p -69.66 -44.55 70.29 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 119.771 -0.771 . . . . 80.66 110.416 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 1.9 m -45.77 -51.0 13.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.517 0.511 . . . . 77.78 109.71 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.4 -41.04 98.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.44 -0.8 . . . . 60.96 110.483 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -59.05 -41.03 86.9 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 117.465 -1.694 . . . . 64.32 111.433 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -58.5 -70.87 0.13 Allowed 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.272 -0.876 . . . . 83.74 110.083 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -37.02 -50.0 0.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 120.659 -0.416 . . . . 70.09 111.544 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 28.0 tp -62.52 -45.44 92.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 119.299 -0.96 . . . . 49.44 110.592 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.52 -38.73 60.28 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.538 0.685 . . . . 79.87 109.868 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -75.91 -43.06 47.02 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 113.01 0.745 . . . . 70.25 113.01 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 119.218 -0.993 . . . . 49.5 109.079 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 20.0 m -71.1 -26.13 62.9 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.814 0.816 . . . . 51.81 110.079 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.07 -49.38 36.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.683 -1.144 . . . . 59.78 108.583 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLU . . . . . 0.474 ' HA ' ' OE2' ' B' ' 133' ' ' GLU . 0.0 OUTLIER -54.99 -51.86 64.9 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.783 1.278 . . . . 61.49 108.326 177.222 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.05 -46.15 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 O-C-N 121.552 -0.718 . . . . 51.21 110.131 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -40.63 68.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.939 -1.101 . . . . 70.77 111.58 -176.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -55.12 -42.48 73.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.049 -1.093 . . . . 76.13 108.049 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' B' ' 137' ' ' LEU . 19.3 mt -79.46 -36.66 38.44 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.506 0.928 . . . . 53.05 113.506 -170.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.3 -52.67 62.76 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.623 0.725 . . . . 73.87 110.424 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -61.89 -36.46 81.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.696 -1.138 . . . . 77.23 111.425 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -75.82 -35.22 60.09 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.177 0.513 . . . . 63.83 111.327 -175.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' D' ' 141' ' ' ASN . 31.2 m-20 -68.62 -39.96 80.59 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.473 -1.24 . . . . 54.67 110.927 -177.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -58.0 -48.75 79.1 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.06 -0.973 . . . . 66.0 111.105 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' VAL . . . . . . . . . . . . . 62.2 t -51.13 -54.5 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.602 -0.888 . . . . 58.68 108.602 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.4 -45.06 80.82 Favored 'General case' 0 C--O 1.209 -1.026 0 CA-C-N 114.191 -1.368 . . . . 55.25 111.487 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -69.6 -29.42 66.94 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 114.618 1.34 . . . . 58.7 114.618 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 44.5 t -73.3 -41.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 108.424 -0.954 . . . . 63.52 108.424 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -60.78 -19.22 58.92 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 113.764 1.024 . . . . 66.85 113.764 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mt -90.74 -35.61 7.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 114.167 -1.379 . . . . 66.68 108.782 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.39 70.31 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.709 -1.132 . . . . 74.84 108.997 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -72.6 -18.21 61.62 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 116.531 2.048 . . . . 78.54 116.531 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 113.822 1.045 . . . . 85.69 113.822 -172.357 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.345 0 CA-C-O 122.513 1.149 . . . . 102.29 109.979 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -56.4 18.58 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.655 -1.611 . . . . 108.17 107.692 170.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -57.38 -26.59 61.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.811 -1.541 . . . . 78.09 113.091 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -75.05 -46.88 31.85 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.762 1.393 . . . . 86.8 114.762 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.76 -44.18 81.51 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.884 0.85 . . . . 60.17 111.83 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' CYS . . . . . . . . . . . . . 5.9 m -59.76 -58.17 9.71 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.119 -0.491 . . . . 45.3 110.834 171.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -43.47 -52.26 6.17 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 115.119 -0.946 . . . . 67.29 109.238 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -76.3 -44.28 37.7 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 121.227 -0.921 . . . . 60.36 112.8 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' GLY . . . . . 0.473 ' HA3' ' CZ ' ' D' ' 81' ' ' PHE . . . -52.26 -51.59 41.08 Favored Glycine 0 N--CA 1.485 1.939 0 CA-C-N 115.261 -0.881 . . . . 44.62 111.605 170.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 57' ' ' LEU . . . . . 0.45 HD11 ' HG3' ' D' ' 78' ' ' GLN . 3.2 tp -64.49 -39.59 94.08 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.444 0.64 . . . . 37.04 111.65 -174.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.89 -46.16 88.5 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-O 121.989 0.899 . . . . 85.21 110.472 178.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.03 -52.66 40.91 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.552 -1.204 . . . . 38.79 112.019 173.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 3.0 t -55.33 -46.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.54 -0.755 . . . . 38.36 108.973 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' MSE . . . . . . . . . . . . . 60.4 mmm -66.86 -37.07 83.73 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.358 0.599 . . . . 76.13 110.836 -175.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' C' ' 65' ' ' ASN . 8.2 tp10 -63.36 -36.3 83.24 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.488 -0.778 . . . . 52.35 109.551 177.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 63' ' ' CYS . . . . . . . . . . . . . 73.3 m -69.87 -50.95 37.5 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.709 -0.678 . . . . 36.52 109.487 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -45.24 -54.31 7.18 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 123.056 1.408 . . . . 73.45 111.654 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' C' ' 62' ' ' GLU . 12.2 t30 -45.27 -57.13 4.21 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 124.383 2.039 . . . . 36.57 116.239 172.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . 0.647 HG13 HG13 ' B' ' 66' ' ' VAL . 1.3 t -65.82 -26.12 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 112.822 -1.99 . . . . 30.25 112.762 177.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 34.0 p -71.06 -25.4 62.62 Favored 'General case' 0 CA--C 1.484 -1.574 0 C-N-CA 117.816 -1.554 . . . . 32.13 111.095 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -70.35 -38.37 74.82 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 104.738 -2.319 . . . . 41.85 104.738 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.01 -42.13 98.83 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 124.794 1.309 . . . . 33.81 110.679 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -53.93 52.01 Favored 'General case' 0 CA--C 1.476 -1.893 0 CA-C-N 116.377 -0.374 . . . . 33.35 110.778 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -50.66 -44.04 57.53 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 112.806 0.669 . . . . 44.03 112.806 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -61.01 -51.06 70.83 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.769 -1.173 . . . . 43.5 107.97 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -63.85 -42.28 97.6 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.768 -0.651 . . . . 30.81 110.176 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' LEU . . . . . . . . . . . . . 57.6 mt -46.38 -46.82 18.74 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-O 121.871 0.843 . . . . 29.67 113.192 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' THR . . . . . 0.722 ' OG1' ' NH2' ' D' ' 64' ' ' ARG . 21.4 m -59.91 -44.42 94.28 Favored 'General case' 0 C--O 1.196 -1.739 0 CA-C-O 118.659 -0.686 . . . . 32.66 110.138 177.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -57.06 -44.08 82.69 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.531 0.605 . . . . 31.16 112.034 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.93 -51.1 68.84 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-O 121.487 0.661 . . . . 22.82 111.144 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' GLN . . . . . 0.824 ' HG3' ' HE1' ' D' ' 61' ' ' MSE . 21.7 tt0 -50.39 -49.05 55.52 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.54 0.686 . . . . 40.41 110.972 175.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 79' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -57.61 -44.15 85.25 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.164 -0.925 . . . . 40.01 109.008 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' GLY . . . . . . . . . . . . . . . -45.32 -58.43 5.17 Favored Glycine 0 C--O 1.205 -1.69 0 CA-C-N 113.477 -1.692 . . . . 23.2 110.388 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -70.65 -28.78 65.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 115.091 1.515 . . . . 29.45 115.091 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -71.44 -39.5 70.99 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 119.169 -1.012 . . . . 45.38 109.616 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.49 -46.66 76.88 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.851 1.31 . . . . 59.91 110.033 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 84' ' ' VAL . 2.3 t -67.18 -42.95 88.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.504 -1.295 . . . . 31.1 107.504 -172.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -56.28 -46.26 79.81 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.572 0.953 . . . . 63.73 113.572 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -51.64 -62.83 1.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.878 -1.156 . . . . 48.19 107.878 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -46.76 -40.05 12.84 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 114.365 1.246 . . . . 46.1 114.365 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.72 -40.86 75.98 Favored 'General case' 0 C--O 1.2 -1.521 0 CA-C-O 121.281 0.563 . . . . 43.22 110.601 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -52.66 -51.84 58.39 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.164 0.507 . . . . 49.51 111.452 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -55.95 -68.61 0.19 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.329 1.061 . . . . 54.3 109.361 178.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 91' ' ' CYS . 19.5 t -40.03 -39.92 0.96 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.902 -1.045 . . . . 69.23 112.389 174.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -69.14 -28.86 66.81 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.836 0.68 . . . . 78.23 112.836 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -50.27 12.03 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.837 -1.172 . . . . 111.54 107.837 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -45.73 -44.35 13.6 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.812 -0.631 . . . . 58.45 110.181 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -61.04 -61.53 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.594 -1.185 . . . . 57.24 109.934 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' MSE . . . . . . . . . . . . . 65.2 mmm -47.62 -39.85 18.03 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 116.148 -0.478 . . . . 113.53 110.41 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.55 -56.99 13.2 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.873 0.844 . . . . 61.07 112.498 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.38 -41.16 84.17 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 116.019 -0.537 . . . . 58.58 112.372 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' MSE . . . . . . . . . . . . . 6.5 mtt -63.65 -12.15 31.43 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.585 0.587 . . . . 106.35 112.585 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.45 -49.8 5.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.23 -0.656 . . . . 61.61 109.23 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' SER . . . . . 0.41 ' O ' ' C ' ' C' ' 102' ' ' LEU . 10.5 m -49.91 -65.64 0.53 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.661 0.743 . . . . 58.7 110.097 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 102' ' ' LEU . . . . . 0.41 ' C ' ' O ' ' C' ' 101' ' ' SER . 15.3 tp -32.69 -60.0 0.31 Allowed 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.701 -0.682 . . . . 62.52 111.448 174.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -58.2 -49.84 75.65 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.197 0.999 . . . . 83.87 112.075 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.92 -41.9 68.2 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 120.623 -0.431 . . . . 63.89 109.885 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -68.02 -46.85 70.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.813 -0.63 . . . . 73.88 111.465 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -51.46 -39.68 57.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.055 -0.975 . . . . 66.77 112.644 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.77 70.15 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.305 0.854 . . . . 68.29 113.305 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.6 -58.68 3.12 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.123 -0.631 . . . . 85.99 109.411 174.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . -41.46 -57.83 3.11 Favored Glycine 0 C--O 1.208 -1.507 0 N-CA-C 108.58 -1.808 . . . . 56.77 108.58 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -42.27 -55.87 3.16 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 123.939 0.896 . . . . 97.6 108.923 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -70.46 -55.8 8.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 113.717 -1.583 . . . . 91.24 111.554 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' C' ' 115' ' ' GLU . 9.3 mptt -48.81 -59.67 3.38 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.87 -1.059 . . . . 74.34 111.749 178.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 113' ' ' VAL . . . . . . . . . . . . . 1.3 t -44.28 -46.32 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.29 0.636 . . . . 50.65 112.141 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.82 -50.79 72.03 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 107.779 -1.193 . . . . 95.32 107.779 -176.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' C' ' 112' ' ' LYS . 2.3 tt0 -38.17 -70.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.693 1.197 . . . . 78.02 113.469 172.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 116' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.07 -37.9 78.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.338 -1.301 . . . . 50.98 111.975 -177.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -62.47 -24.88 67.69 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.433 -0.907 . . . . 69.71 112.441 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.45 -43.87 14.56 Favored Glycine 0 C--O 1.222 -0.626 0 N-CA-C 110.935 -0.866 . . . . 55.8 110.935 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -55.26 -43.72 74.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.947 -0.76 . . . . 61.29 108.947 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ILE . . . . . 0.661 HD12 HG13 ' A' ' 120' ' ' ILE . 1.4 mp -55.02 -50.66 61.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 CA-C-N 115.515 -0.766 . . . . 45.47 111.135 174.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' THR . . . . . . . . . . . . . 65.0 m -64.2 -40.03 95.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.155 -1.018 . . . . 59.33 111.732 -172.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.79 -35.05 67.3 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.477 0.656 . . . . 63.47 111.103 -173.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 24.7 mt -62.7 -44.85 95.18 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.614 -1.175 . . . . 45.52 108.903 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.28 -39.19 75.18 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.324 -0.95 . . . . 52.5 113.201 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' HIS . . . . . 0.49 ' HA ' ' OE1' ' C' ' 128' ' ' GLN . 65.1 m170 -72.63 -45.48 58.8 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.015 -0.993 . . . . 69.14 109.454 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -58.12 -40.0 80.13 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.885 -1.052 . . . . 57.6 109.766 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' LEU . . . . . . . . . . . . . 20.3 tp -59.83 -44.58 93.98 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 119.784 -0.766 . . . . 39.66 110.708 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' GLN . . . . . 0.49 ' OE1' ' HA ' ' C' ' 125' ' ' HIS . 19.8 mt-30 -63.15 -46.44 87.17 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.851 -0.613 . . . . 56.25 111.902 177.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -50.93 -35.89 35.72 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 114.556 1.317 . . . . 66.38 114.556 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.59 -42.22 14.55 Favored 'General case' 0 CA--C 1.491 -1.298 0 N-CA-C 107.242 -1.392 . . . . 44.0 107.242 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 16.8 m -57.04 -30.71 64.46 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.247 -0.888 . . . . 43.36 110.843 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -63.95 0.96 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 114.817 -1.083 . . . . 52.01 109.756 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -50.22 -29.27 9.09 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.061 -0.972 . . . . 60.74 110.732 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 134' ' ' VAL . . . . . . . . . . . . . 5.4 t -65.26 -57.31 11.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.508 -0.923 . . . . 44.29 108.508 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 135' ' ' GLU . . . . . 0.597 ' HA ' ' OE1' ' C' ' 135' ' ' GLU . 0.2 OUTLIER -39.14 -50.41 1.88 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 125.658 1.849 . . . . 57.54 115.702 172.123 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 136' ' ' ARG . . . . . . . . . . . . . 59.2 ttp85 -47.48 -45.68 26.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.238 -1.347 . . . . 83.01 108.005 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 18.7 mt -86.75 -40.66 14.8 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 114.036 1.125 . . . . 47.44 114.036 -167.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 138' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -53.1 -34.21 55.65 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 117.807 -1.557 . . . . 59.62 109.002 170.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 32.2 mtm-85 -63.54 -66.05 0.6 Allowed 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.028 -0.73 . . . . 69.71 109.028 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -41.48 -44.75 3.01 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 113.383 0.883 . . . . 65.44 113.383 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.43 -57.99 10.57 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.574 0.702 . . . . 66.1 112.152 -175.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -56.89 -47.74 79.78 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-N 114.126 -1.397 . . . . 72.85 111.053 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.7 -61.47 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 113.994 -1.457 . . . . 57.59 109.796 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.29 -37.63 78.16 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.365 -0.534 . . . . 48.97 112.314 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 145' ' ' SER . . . . . . . . . . . . . 3.0 p -68.13 -27.99 66.93 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 121.722 0.772 . . . . 46.02 111.348 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 146' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.85 -50.08 35.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 CA-C-O 122.421 1.105 . . . . 59.5 108.904 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 147' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -48.37 -38.72 20.08 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.862 -0.735 . . . . 73.47 110.468 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' ILE . . . . . . . . . . . . . 47.0 mt -68.11 -45.16 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 CA-C-O 121.607 0.718 . . . . 49.33 112.106 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 149' ' ' ALA . . . . . . . . . . . . . . . -51.28 -54.21 28.17 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.058 -0.973 . . . . 57.48 110.798 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 150' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -45.27 -55.41 5.92 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.974 1.101 . . . . 73.82 113.974 174.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 151' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.968 0 CA-C-N 115.021 -0.991 . . . . 81.4 111.547 -166.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.514 2.726 0 N-CA-C 113.099 0.777 . . . . 67.63 113.099 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -32.67 74.5 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 115.097 -0.956 . . . . 100.62 113.006 170.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 52' ' ' ALA . . . . . 0.498 ' CB ' HG23 ' A' ' 84' ' ' VAL . . . -59.37 -41.94 90.46 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 113.278 0.844 . . . . 62.86 113.278 -179.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 53' ' ' CYS . . . . . 0.473 ' SG ' HG12 ' C' ' 84' ' ' VAL . 50.9 m -58.73 -53.02 63.04 Favored 'General case' 0 C--O 1.2 -1.514 0 O-C-N 120.973 -1.079 . . . . 47.79 110.409 176.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -54.42 -52.49 61.61 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 113.641 -1.618 . . . . 113.25 108.685 -174.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.7 -43.18 85.07 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.661 -0.7 . . . . 60.02 111.884 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.12 98.02 Favored Glycine 0 C--O 1.206 -1.595 0 N-CA-C 110.232 -1.147 . . . . 39.9 110.232 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.33 -39.99 89.6 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 107.109 -1.441 . . . . 30.82 107.109 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' ARG . . . . . 0.473 ' HD3' ' O ' ' D' ' 2' ' ' HOH . 3.0 ttp180 -60.36 -52.68 64.22 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.43 -0.908 . . . . 43.42 109.097 -177.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.0 -39.04 68.63 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 119.786 -0.766 . . . . 37.17 111.084 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.81 -50.9 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 119.2 -1.0 . . . . 34.84 110.402 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' MSE . . . . . 0.824 ' HE1' ' HG3' ' C' ' 78' ' ' GLN . 28.0 mmt -55.33 -38.75 69.13 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.507 -0.923 . . . . 65.96 108.507 178.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -67.0 -40.72 87.39 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.607 -1.237 . . . . 47.63 111.25 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' CYS . . . . . . . . . . . . . 81.5 m -58.86 -34.9 72.11 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 120.41 -1.431 . . . . 36.93 109.846 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 64' ' ' ARG . . . . . 0.722 ' NH2' ' OG1' ' C' ' 75' ' ' THR . 25.2 ttm-85 -63.91 -50.17 69.77 Favored 'General case' 0 C--N 1.278 -2.519 0 CA-C-N 114.258 -1.337 . . . . 45.32 107.58 -177.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -56.87 -42.68 80.23 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-O 122.175 0.988 . . . . 30.21 113.029 178.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 83.7 t -70.37 -46.55 70.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 112.949 -1.932 . . . . 31.67 110.765 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' THR . . . . . . . . . . . . . 98.2 m -60.09 -34.14 73.06 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.703 -1.142 . . . . 30.13 112.156 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -62.27 -34.14 75.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 116.737 -1.985 . . . . 33.93 111.258 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 14.7 tp -73.47 -40.77 63.89 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.531 1.158 . . . . 33.01 107.975 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' LEU . . . . . . . . . . . . . 8.5 tp -50.9 -52.68 39.6 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 114.243 -1.344 . . . . 32.13 112.188 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -53.19 -43.4 67.13 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.843 1.423 . . . . 36.81 114.843 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -66.3 -39.28 89.22 Favored 'General case' 0 C--O 1.26 1.611 0 C-N-CA 119.818 -0.753 . . . . 35.9 112.295 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -73.0 -36.37 67.03 Favored 'General case' 0 C--O 1.205 -1.249 0 C-N-CA 118.626 -1.23 . . . . 33.81 110.461 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 74' ' ' LEU . . . . . . . . . . . . . 49.9 mt -59.85 -38.66 82.72 Favored 'General case' 0 C--O 1.254 1.308 0 N-CA-C 113.102 0.778 . . . . 31.82 113.102 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 54.4 m -63.61 -41.14 98.33 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 122.684 1.23 . . . . 34.32 108.09 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -65.13 -34.28 78.03 Favored 'General case' 0 C--O 1.193 -1.908 0 CA-C-N 114.653 -1.158 . . . . 34.92 112.718 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.07 84.08 Favored 'General case' 0 C--O 1.19 -2.071 0 O-C-N 119.935 -1.728 . . . . 27.43 113.04 170.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' GLN . . . . . 0.45 ' HG3' HD11 ' C' ' 57' ' ' LEU . 63.8 tt0 -50.54 -42.05 54.73 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 107.87 -1.159 . . . . 45.0 107.87 173.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 79' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -61.93 -46.46 89.23 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.862 0.69 . . . . 43.44 112.862 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' GLY . . . . . . . . . . . . . . . -49.64 -51.57 27.64 Favored Glycine 0 N--CA 1.479 1.549 0 CA-C-N 115.786 -0.643 . . . . 27.37 112.336 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' PHE . . . . . 0.473 ' CZ ' ' HA3' ' C' ' 56' ' ' GLY . 13.4 m-85 -65.47 -28.59 69.32 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 112.676 0.621 . . . . 36.18 112.676 -173.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 82' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -80.72 -43.05 20.88 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.197 -1.001 . . . . 47.27 110.092 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.58 -35.45 72.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 118.753 -1.179 . . . . 38.54 109.515 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' VAL . . . . . 0.534 HG11 HG11 ' B' ' 84' ' ' VAL . 1.8 t -72.2 -49.78 40.87 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 O-C-N 121.419 -0.8 . . . . 34.04 112.776 -176.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -47.09 -37.31 9.42 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.77 1.228 . . . . 54.4 112.674 169.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.01 83.92 Favored 'General case' 0 C--O 1.198 -1.609 0 N-CA-C 108.619 -0.882 . . . . 44.99 108.619 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.55 -40.62 25.57 Favored 'General case' 0 C--O 1.21 -1.016 0 O-C-N 124.113 0.883 . . . . 74.59 113.208 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.65 -28.06 8.16 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 106.737 -1.579 . . . . 48.94 106.737 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.27 9.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 118.325 -1.35 . . . . 50.88 109.879 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' THR . . . . . . . . . . . . . 60.6 m -46.64 -47.91 20.05 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 104.797 -2.297 . . . . 53.61 104.797 176.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' CYS . . . . . . . . . . . . . 57.5 m -70.01 -50.22 43.67 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.962 1.467 . . . . 60.06 114.962 -172.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -54.33 -56.44 18.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.783 0.801 . . . . 79.07 108.918 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -40.24 -58.15 1.56 Allowed 'General case' 0 C--O 1.212 -0.879 0 CA-C-N 114.967 -1.015 . . . . 65.2 109.998 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 24.0 m -51.67 -63.89 0.99 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 119.781 -0.767 . . . . 62.9 109.325 -174.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' VAL . . . . . 0.441 HG12 ' N ' ' D' ' 96' ' ' MSE . 1.8 t -39.99 -55.77 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.638 0.775 . . . . 63.65 112.187 174.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 96' ' ' MSE . . . . . 0.441 ' N ' HG12 ' D' ' 95' ' ' VAL . 0.0 OUTLIER -51.66 -47.13 63.92 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.083 -0.962 . . . . 116.78 110.414 -179.04 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.24 -35.5 67.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.248 0.619 . . . . 67.61 111.956 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.87 -50.07 12.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.251 -0.886 . . . . 74.76 112.179 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' MSE . . . . . . . . . . . . . 91.6 mtp -45.72 -46.13 14.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.643 -0.708 . . . . 120.39 109.322 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.21 98.78 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 114.811 -1.086 . . . . 76.99 110.38 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -35.55 81.5 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 122.181 0.991 . . . . 66.17 112.212 179.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 102' ' ' LEU . . . . . 0.857 HD12 HD12 ' B' ' 102' ' ' LEU . 10.5 tp -68.14 -61.9 1.64 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.134 -0.939 . . . . 70.87 110.109 176.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -44.2 -35.21 2.14 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 115.106 1.521 . . . . 91.69 115.106 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.44 -26.8 46.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.054 -0.721 . . . . 76.87 109.054 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -69.81 -35.3 74.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.35 -1.295 . . . . 77.33 111.125 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -66.95 -35.35 79.78 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.801 -0.636 . . . . 97.4 110.552 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.98 58.86 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 114.328 -1.305 . . . . 85.45 111.454 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -83.08 -33.03 26.48 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.353 1.033 . . . . 85.64 108.46 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.15 -52.43 5.68 Favored Glycine 0 C--O 1.21 -1.373 0 CA-C-N 115.293 -0.867 . . . . 72.62 113.916 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.99 -7.6 59.62 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.116 0.413 . . . . 98.09 112.116 -175.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' D' ' 115' ' ' GLU . 44.1 tttt -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.57 -0.741 . . . . 109.27 110.157 172.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -69.37 -54.76 12.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.831 -0.803 . . . . 92.84 108.831 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.91 -52.92 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.359 1.064 . . . . 69.47 112.256 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -88.38 -1.96 58.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.855 -1.066 . . . . 118.89 110.866 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' D' ' 111' ' ' LYS . 0.0 OUTLIER -86.23 -29.37 23.2 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.717 -1.216 . . . . 106.69 107.717 167.708 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 116' ' ' LEU . . . . . 0.407 HD13 ' HG2' ' D' ' 115' ' ' GLU . 0.1 OUTLIER -94.02 -12.01 29.54 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.213 -1.358 . . . . 96.8 113.522 178.786 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 117' ' ' GLU . . . . . 0.697 ' HA ' HG12 ' D' ' 120' ' ' ILE . 52.1 mt-10 -90.76 -27.56 18.84 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 121.699 0.761 . . . . 84.99 111.954 173.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.62 9.78 41.4 Favored Glycine 0 N--CA 1.471 1.003 0 N-CA-C 109.288 -1.525 . . . . 85.5 109.288 168.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.4 -34.4 6.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 113.945 -1.127 . . . . 84.96 109.326 169.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 120' ' ' ILE . . . . . 0.697 HG12 ' HA ' ' D' ' 117' ' ' GLU . 36.3 mm -54.91 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.836 0 N-CA-C 108.082 -1.081 . . . . 65.85 108.082 171.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 121' ' ' THR . . . . . 0.414 ' HA ' ' HB2' ' D' ' 124' ' ' ASN . 55.4 p -54.99 -31.4 60.94 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.621 -1.172 . . . . 79.97 110.151 -170.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 122' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -16.68 61.26 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.629 0.974 . . . . 84.78 113.629 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 123' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.39 -39.91 12.39 Favored 'General case' 0 C--O 1.216 -0.68 0 N-CA-C 108.26 -1.015 . . . . 70.45 108.26 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' ASN . . . . . 0.414 ' HB2' ' HA ' ' D' ' 121' ' ' THR . 1.7 m-20 -51.85 -53.28 42.23 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.944 1.831 . . . . 66.48 115.944 174.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 125' ' ' HIS . . . . . 0.44 ' HA ' ' OE1' ' D' ' 128' ' ' GLN . 4.7 m-70 -51.19 -43.89 61.43 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.987 -0.551 . . . . 87.98 110.869 173.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 126' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -60.8 -41.32 95.43 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.551 0.574 . . . . 72.88 112.551 176.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 127' ' ' LEU . . . . . . . . . . . . . 17.2 tp -61.29 -62.39 1.87 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.469 -0.787 . . . . 57.07 109.617 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' D' ' 125' ' ' HIS . 59.8 mt-30 -43.26 -39.26 2.93 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 112.939 0.718 . . . . 84.24 112.939 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.06 -44.61 12.87 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.797 -0.638 . . . . 82.82 111.361 -170.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.1 -27.31 67.24 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.595 -0.73 . . . . 60.99 110.192 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 12.1 p -91.7 -1.66 57.33 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 117.301 -1.76 . . . . 60.7 112.635 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.47 37.42 Favored 'General case' 0 CA--C 1.489 -1.402 0 N-CA-C 105.558 -2.016 . . . . 71.3 105.558 168.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.38 -29.83 68.63 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.993 -1.458 . . . . 74.08 111.596 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' VAL . . . . . 0.442 HG22 ' HB3' ' B' ' 133' ' ' GLU . 7.1 t -67.69 -47.74 78.81 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.685 -0.806 . . . . 58.2 109.307 174.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 135' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -59.37 -36.47 75.82 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 114.299 1.222 . . . . 85.16 114.299 174.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -59.25 -61.4 2.66 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 108.282 -1.007 . . . . 85.1 108.282 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 137' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.31 -34.93 76.05 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.33 -1.759 . . . . 62.95 113.259 -172.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 10.3 ttp85 -63.31 -59.53 4.59 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 120.967 0.413 . . . . 95.96 111.599 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 139' ' ' ARG . . . . . . . . . . . . . 36.4 mtm-85 -48.79 -43.36 37.98 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.503 -0.748 . . . . 97.91 110.731 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.93 -27.9 62.13 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.407 0.891 . . . . 90.02 113.407 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' B' ' 141' ' ' ASN . 0.5 OUTLIER -67.29 -45.38 76.74 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.595 -0.442 . . . . 73.16 110.932 170.226 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 142' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -64.94 -32.93 74.88 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 116.036 -0.529 . . . . 77.64 111.848 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 143' ' ' VAL . . . . . . . . . . . . . 5.1 t -60.16 -63.22 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.467 -1.309 . . . . 78.07 107.467 173.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 16.9 mt -52.2 -40.19 61.22 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 115.372 -0.831 . . . . 64.65 112.718 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 145' ' ' SER . . . . . . . . . . . . . 2.9 m -59.54 -30.23 68.46 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.063 0.458 . . . . 63.97 111.726 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -89.72 -31.94 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 CA-C-N 114.86 -1.064 . . . . 79.84 110.82 -172.466 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 147' ' ' ARG . . . . . . . . . . . . . 50.2 mtp180 -61.99 -28.52 69.62 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 115.906 -0.588 . . . . 87.94 112.044 165.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 148' ' ' ILE . . . . . . . . . . . . . 1.4 mm -69.24 -59.11 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 109.463 -0.569 . . . . 73.38 109.463 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.65 -24.54 63.95 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 113.961 1.097 . . . . 81.65 113.961 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 N--CA 1.495 1.821 0 C-N-CA 123.715 0.806 . . . . 100.45 111.45 177.139 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . 0.811 ' O ' ' HD3' ' B' ' 64' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . 0.573 ' O ' ' HG3' ' A' ' 76' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 15' ' ' HOH . . . . . 0.893 ' O ' HD23 ' B' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' HOH . . . . . 0.456 ' O ' ' HG2' ' B' ' 79' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' HOH . . . . . 0.473 ' O ' ' HD3' ' D' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 113.078 0.77 . . . . 114.09 113.078 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -55.03 -87.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.287 -1.005 . . . . 102.93 108.287 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.3 m -64.15 -9.88 19.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 117.096 2.258 . . . . 90.35 117.096 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.43 -26.87 65.55 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 115.013 1.486 . . . . 114.68 115.013 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.77 -41.48 26.49 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.517 0.562 . . . . 69.01 112.517 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' B' ' 84' ' ' VAL . 0.8 OUTLIER -59.81 -40.46 88.5 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.276 0.843 . . . . 49.04 113.276 170.002 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.34 -58.85 6.16 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 124.296 1.038 . . . . 105.78 110.012 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -57.89 -41.18 82.0 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.449 -0.796 . . . . 71.58 111.536 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.02 -40.88 92.02 Favored Glycine 0 C--O 1.2 -2.022 0 CA-C-N 114.559 -1.201 . . . . 41.65 112.051 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD22 ' HE2' ' A' ' 61' ' ' MSE . 11.3 mt -69.73 -39.28 76.9 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.423 -1.045 . . . . 33.06 112.87 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.1 mtp180 -65.3 -45.73 83.23 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.38 0.61 . . . . 81.55 110.917 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.49 -40.09 65.09 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 107.867 -1.16 . . . . 39.15 107.867 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -68.13 -41.86 84.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 C-N-CA 119.57 -0.852 . . . . 30.34 109.818 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' MSE . . . . . 0.439 ' HE2' HD22 ' A' ' 57' ' ' LEU . 11.0 mmt -64.09 -39.96 95.19 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 114.05 -1.432 . . . . 71.98 111.775 175.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -64.97 -37.15 86.7 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 107.381 -1.34 . . . . 52.23 107.381 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 67' ' ' THR . 68.5 m -60.78 -43.02 98.61 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.797 -1.161 . . . . 31.85 110.014 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 12.6 ttm-85 -62.04 -43.46 98.79 Favored 'General case' 0 C--N 1.29 -2.007 0 C-N-CA 120.087 -0.645 . . . . 44.91 109.754 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -66.1 -41.31 90.81 Favored 'General case' 0 C--O 1.2 -1.509 0 C-N-CA 118.521 -1.272 . . . . 40.98 112.703 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.5 t -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-N 114.997 -1.001 . . . . 35.82 111.067 176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 63' ' ' CYS 0.285 2.3 p -67.84 -31.19 70.86 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 116.295 -2.162 . . . . 30.95 113.879 -179.822 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -53.91 -44.18 70.33 Favored 'General case' 0 N--CA 1.512 2.642 0 CA-C-N 119.501 1.046 . . . . 37.78 110.265 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.61 -40.68 95.7 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-O 122.874 1.321 . . . . 35.89 111.807 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 tp -54.32 -57.22 12.09 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.696 -1.138 . . . . 25.16 111.936 170.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -48.05 -42.61 28.91 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.293 0.37 . . . . 30.37 110.498 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.07 -47.86 81.12 Favored 'General case' 0 C--O 1.245 0.837 0 C-N-CA 119.34 -0.944 . . . . 36.53 109.519 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.451 ' OE2' ' NH2' ' D' ' 58' ' ' ARG . 45.5 mm-40 -69.91 -31.46 69.26 Favored 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 116.513 -2.075 . . . . 33.35 111.824 -174.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 23.3 mt -64.85 -38.18 90.1 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 120.754 -1.216 . . . . 23.69 112.694 173.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.6 m -58.15 -45.1 88.02 Favored 'General case' 0 C--O 1.197 -1.69 0 N-CA-C 108.186 -1.042 . . . . 29.0 108.186 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 12' ' ' HOH . 3.4 tp10 -61.28 -46.02 92.07 Favored 'General case' 0 CA--C 1.56 1.355 0 N-CA-C 114.235 1.198 . . . . 45.51 114.235 174.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.63 -35.62 61.16 Favored 'General case' 0 N--CA 1.523 3.224 0 O-C-N 120.993 -1.067 . . . . 24.92 113.091 169.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -71.76 -40.09 69.54 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.357 -0.838 . . . . 55.13 109.841 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' A' ' 80' ' ' GLY . 32.7 tttt -54.92 -57.53 11.25 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 104.455 -2.424 . . . . 53.16 104.455 173.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 79' ' ' LYS . . . -31.84 -59.12 0.34 Allowed Glycine 0 C--N 1.291 -1.953 0 CA-C-N 115.417 -0.81 . . . . 22.74 113.535 176.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -71.45 -37.7 71.38 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 118.595 1.198 . . . . 32.35 113.403 -171.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -55.51 -53.39 56.9 Favored 'General case' 0 C--O 1.199 -1.572 0 N-CA-C 104.889 -2.263 . . . . 43.72 104.889 175.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -63.82 -38.99 93.15 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 120.111 -1.618 . . . . 30.43 114.112 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.823 HG11 HG11 ' C' ' 84' ' ' VAL . 2.2 t -58.0 -45.44 88.0 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.614 0 O-C-N 120.643 -1.286 . . . . 28.41 110.442 -179.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -51.84 -43.38 63.17 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.299 0.852 . . . . 59.13 113.299 167.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -55.65 -60.5 3.36 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.658 -1.608 . . . . 35.75 106.658 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -54.68 -39.48 68.16 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.364 1.616 . . . . 35.55 115.364 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' ' C ' ' A' ' 89' ' ' ALA . . . -60.74 -43.32 98.08 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.776 -1.194 . . . . 35.11 107.776 179.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.445 ' C ' ' O ' ' A' ' 88' ' ' ALA . . . -56.58 -53.18 60.57 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 104.51 -2.404 . . . . 40.74 104.51 -173.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 28.4 m -51.98 -48.31 64.44 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.906 1.282 . . . . 35.48 111.999 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.45 ' HB3' ' SG ' ' C' ' 91' ' ' CYS . 97.7 m -63.44 -41.9 98.66 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 114.352 1.242 . . . . 52.87 114.352 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.8 -37.59 84.96 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.934 0.873 . . . . 65.95 110.999 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -64.46 -48.28 75.86 Favored 'General case' 0 C--O 1.21 -1.012 0 N-CA-C 107.848 -1.167 . . . . 60.73 107.848 175.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.2 m -52.13 -49.3 63.97 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 119.531 -0.867 . . . . 47.2 108.951 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -51.35 70.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 122.168 -0.332 . . . . 51.62 110.934 -177.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' MSE . . . . . . . . . . . . . 25.0 mtp -61.49 -36.12 79.6 Favored 'General case' 0 C--O 1.214 -0.81 0 O-C-N 124.608 1.193 . . . . 136.81 110.536 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -73.56 -41.74 62.57 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.398 -0.921 . . . . 58.74 109.348 -178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.96 -40.99 95.49 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.166 -0.47 . . . . 51.45 111.188 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' MSE . . . . . . . . . . . . . 10.7 mtp -68.8 -41.95 77.97 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.429 0.633 . . . . 106.19 112.134 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -50.03 -58.95 4.42 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.517 -1.29 . . . . 54.91 107.517 172.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . 0.273 0.1 OUTLIER -72.79 -13.54 61.33 Favored 'General case' 0 C--O 1.206 -1.209 0 C-N-CA 119.759 -0.777 . . . . 51.52 111.803 -169.736 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.49 -54.27 9.74 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.158 -0.682 . . . . 57.2 109.158 166.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -49.18 -52.46 26.51 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 115.613 -0.721 . . . . 69.56 111.221 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' A' ' 105' ' ' GLU . . . -46.72 -63.94 0.89 Allowed 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.362 -0.977 . . . . 50.77 108.362 174.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 104' ' ' ALA . 12.6 tp10 -45.47 -51.09 12.07 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 118.997 -1.081 . . . . 61.17 111.626 -175.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -52.23 -45.93 65.5 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.099 1.148 . . . . 75.2 114.099 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.91 -54.23 14.37 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.861 0.864 . . . . 66.87 111.235 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.3 mm-40 -54.96 -39.72 69.23 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 122.119 0.961 . . . . 85.94 108.412 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -65.69 -53.6 30.46 Favored Glycine 0 N--CA 1.476 1.349 0 CA-C-N 114.14 -1.391 . . . . 56.01 113.279 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -8.55 57.57 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.999 -0.68 . . . . 84.74 109.839 -175.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 23.1 ttpp -77.08 -43.72 33.26 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 114.93 -1.032 . . . . 82.01 109.523 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.2 -46.49 64.45 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 120.093 -0.643 . . . . 74.41 109.82 -178.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 42.2 t -44.03 -52.46 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.86 -0.336 . . . . 49.87 110.986 172.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.05 -34.25 77.65 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.503 0.557 . . . . 77.77 112.503 -174.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.94 -34.83 77.34 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.838 -0.619 . . . . 84.4 111.103 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.4 mt -89.54 -27.87 19.99 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.981 -1.008 . . . . 48.02 111.675 -178.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -70.33 -34.19 72.38 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 119.278 -0.969 . . . . 71.2 109.697 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.402 ' O ' ' HB ' ' A' ' 121' ' ' THR . . . -57.66 -56.39 25.39 Favored Glycine 0 C--N 1.311 -0.811 0 N-CA-C 108.542 -1.823 . . . . 57.48 108.542 173.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -29.84 71.12 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.399 0.889 . . . . 63.04 113.399 -174.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.661 HG13 HD12 ' C' ' 120' ' ' ILE . 1.2 mt -62.05 -45.04 99.61 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.948 -1.13 . . . . 43.21 107.948 175.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' THR . . . . . 0.402 ' HB ' ' O ' ' A' ' 118' ' ' GLY . 0.9 OUTLIER -50.62 -59.01 4.49 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.068 -1.423 . . . . 55.99 111.789 -179.229 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 p -61.76 -41.04 97.16 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.475 -0.935 . . . . 56.98 108.475 -176.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.3 mt -63.24 -32.13 73.46 Favored 'General case' 0 C--O 1.196 -1.727 0 C-N-CA 120.256 -0.578 . . . . 45.65 111.978 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.448 ' O ' ' HG3' ' A' ' 128' ' ' GLN . 93.8 m-20 -66.97 -44.3 80.84 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.242 1.02 . . . . 48.59 108.919 177.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 64.7 m170 -58.85 -47.16 85.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.479 -1.237 . . . . 62.01 108.294 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -62.78 -32.33 73.47 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-N 114.719 -1.128 . . . . 53.52 110.257 -174.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 17.0 tp -75.77 -31.63 59.58 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.774 0.797 . . . . 37.72 110.479 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 124' ' ' ASN . 88.8 mt-30 -67.63 -34.75 77.6 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 118.665 -1.214 . . . . 57.76 109.829 173.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -72.08 -50.42 28.39 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 116.364 -0.38 . . . . 51.18 111.675 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -44.1 81.53 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.445 -0.798 . . . . 36.23 112.853 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 38.2 m -67.95 -33.59 74.96 Favored 'General case' 0 C--O 1.247 0.972 0 C-N-CA 118.948 -1.101 . . . . 37.92 111.674 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.04 -45.63 84.62 Favored 'General case' 0 C--O 1.209 -1.072 0 N-CA-C 106.386 -1.709 . . . . 43.49 106.386 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.77 -33.24 75.23 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.695 -1.138 . . . . 60.68 111.399 -175.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 48.5 t -65.97 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 CA-C-N 115.33 -0.85 . . . . 42.9 112.734 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -80.46 -29.31 37.48 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 107.943 -1.132 . . . . 65.45 107.943 -177.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.433 HH21 HD21 ' A' ' 137' ' ' LEU . 1.2 ttp180 -60.64 -57.17 13.86 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.16 -1.422 . . . . 66.06 107.16 175.625 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.433 HD21 HH21 ' A' ' 136' ' ' ARG . 26.4 mt -66.12 -26.81 67.62 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.534 0.939 . . . . 43.65 113.534 -177.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 34.6 ttm105 -65.73 -46.25 79.62 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.133 -1.427 . . . . 62.25 112.687 170.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' A' ' 142' ' ' GLN . 92.6 mtm-85 -60.39 -58.73 7.25 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 118.59 -1.244 . . . . 69.12 108.316 178.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -46.37 -41.6 13.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.57 0.7 . . . . 61.06 111.633 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.84 -53.55 56.9 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.998 -1.001 . . . . 57.99 110.206 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 139' ' ' ARG . 3.2 pt20 -62.07 -37.36 84.71 Favored 'General case' 0 C--O 1.207 -1.183 0 N-CA-C 108.296 -1.002 . . . . 65.25 108.296 -171.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 13.8 t -65.45 -30.83 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 112.72 0.637 . . . . 49.36 112.72 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 75.8 mt -82.68 -41.54 19.24 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 119.914 -0.714 . . . . 48.46 110.288 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 3.3 m -46.84 -51.23 17.05 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.351 -0.84 . . . . 53.53 110.615 168.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 79.1 t -62.64 -47.14 94.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 113.047 0.758 . . . . 56.21 113.047 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -55.8 -16.05 3.98 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 114.827 1.418 . . . . 65.09 114.827 171.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 20.4 mt -89.61 -42.56 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 121.374 0.607 . . . . 71.94 111.548 175.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.89 -46.18 90.16 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.111 0.782 . . . . 92.26 113.111 170.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.43 4.49 12.99 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.269 0.557 . . . . 92.17 110.371 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 34.8 tttt -82.56 -48.06 11.42 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.637 -0.71 . . . . 131.11 111.243 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 5.4 mttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.387 0.613 . . . . 93.13 111.231 174.815 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.512 2.635 0 N-CA-C 112.168 0.432 . . . . 87.45 112.168 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.85 26.34 4.14 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.444 1.116 . . . . 106.41 110.484 167.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -91.06 -43.92 9.62 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-N 114.504 -1.225 . . . . 80.08 111.578 170.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -53.13 -35.88 60.18 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 114.264 -1.335 . . . . 75.86 109.938 165.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -72.25 -46.23 56.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.937 0.717 . . . . 117.84 112.937 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.55 -42.23 92.14 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.367 -0.533 . . . . 66.04 111.293 173.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 6.3 m -55.65 -50.93 68.89 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.028 -1.069 . . . . 49.01 109.133 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -45.43 -56.98 4.42 Favored 'General case' 0 C--O 1.2 -1.543 0 CA-C-N 114.776 -1.102 . . . . 72.23 113.075 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -57.26 -50.72 71.99 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.611 -0.681 . . . . 73.92 109.865 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -40.77 -54.26 3.55 Favored Glycine 0 N--CA 1.487 2.037 0 O-C-N 125.431 1.707 . . . . 44.36 112.068 170.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 13.0 mt -64.28 -36.47 84.2 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 113.574 0.953 . . . . 38.24 113.574 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -57.06 -52.91 63.38 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 112.697 0.628 . . . . 89.84 112.697 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.41 -40.72 78.93 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.125 0.964 . . . . 44.5 111.502 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.78 -41.84 92.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.136 0 C-N-CA 118.797 -1.161 . . . . 34.99 110.805 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' MSE . . . . . . . . . . . . . 23.9 ttp -68.37 -40.31 81.46 Favored 'General case' 0 C--O 1.206 -1.23 0 N-CA-C 113.056 0.761 . . . . 80.46 113.056 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -55.36 -39.58 70.23 Favored 'General case' 0 C--O 1.209 -1.061 0 CA-C-O 121.265 0.555 . . . . 60.48 110.486 169.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.48 -42.84 91.76 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.133 -0.627 . . . . 35.85 111.292 -177.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ARG . . . . . 0.811 ' HD3' ' O ' ' A' ' 11' ' ' HOH . 73.1 mtm180 -61.06 -52.87 63.11 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.557 -0.747 . . . . 46.24 112.631 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASN . . . . . 0.732 ' O ' ' HB3' ' B' ' 68' ' ' HIS . 79.8 m-20 -52.13 -45.13 64.85 Favored 'General case' 0 C--O 1.198 -1.613 0 C-N-CA 119.385 -0.926 . . . . 54.2 112.184 176.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.647 HG13 HG13 ' C' ' 66' ' ' VAL . 9.0 t -63.68 -48.14 87.99 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.969 0 CA-C-N 114.842 -1.072 . . . . 43.81 112.732 -176.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 37.0 p -57.37 -22.69 44.25 Favored 'General case' 0 C--O 1.201 -1.448 0 C-N-CA 119.531 -0.868 . . . . 36.35 109.015 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.732 ' HB3' ' O ' ' B' ' 65' ' ' ASN . 23.2 t-80 -60.51 -56.0 26.7 Favored 'General case' 0 C--O 1.193 -1.877 0 CA-C-N 114.926 -1.034 . . . . 68.81 110.367 175.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.893 HD23 ' O ' ' B' ' 15' ' ' HOH . 6.8 mt -57.03 -43.51 81.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 122.005 0.907 . . . . 58.77 111.062 175.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 5.6 tp -50.99 -50.68 57.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.397 -1.274 . . . . 40.05 110.261 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.479 ' OE1' ' HA ' ' B' ' 71' ' ' GLN . 11.8 mm-40 -53.19 -50.11 65.32 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 113.786 -1.552 . . . . 69.07 110.161 178.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . 0.26 11.4 pt20 -71.76 -41.53 68.29 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.839 1.052 . . . . 71.08 113.839 -175.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -62.11 -31.32 71.77 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.643 -1.223 . . . . 56.15 108.159 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 25.8 mt -60.12 -37.54 80.35 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.691 0.758 . . . . 36.55 111.173 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 16.1 m -65.55 -38.57 89.97 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.047 -0.979 . . . . 49.06 109.563 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -66.04 -42.25 89.8 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 120.236 -0.586 . . . . 49.34 111.652 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.58 77.24 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 107.421 -1.326 . . . . 34.04 107.421 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.1 -39.86 93.73 Favored 'General case' 0 C--O 1.208 -1.1 0 O-C-N 121.9 -0.5 . . . . 57.65 110.834 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' B' ' 16' ' ' HOH . 23.1 mttt -60.04 -41.67 92.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 122.75 1.262 . . . . 61.44 108.698 179.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -55.63 -53.01 44.43 Favored Glycine 0 C--N 1.303 -1.257 0 CA-C-N 113.723 -1.581 . . . . 34.59 113.202 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -65.25 -31.21 72.25 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.891 -0.723 . . . . 45.02 111.067 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -74.78 -39.28 61.85 Favored 'General case' 0 C--O 1.209 -1.063 0 N-CA-C 109.021 -0.733 . . . . 62.71 109.021 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.05 -37.53 86.08 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.775 0.798 . . . . 49.84 110.688 173.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 53' ' ' CYS . 1.5 t -63.33 -34.75 69.0 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 O-C-N 121.641 -0.662 . . . . 47.52 110.211 177.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -69.14 -46.86 66.56 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.552 0.691 . . . . 83.54 109.323 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.56 -50.89 66.87 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.421 -1.263 . . . . 62.92 108.31 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.49 -40.55 87.37 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.937 0.717 . . . . 72.65 112.937 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.57 62.92 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 121.35 0.595 . . . . 66.95 109.509 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -52.97 31.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.05 -0.977 . . . . 78.27 109.042 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 93' ' ' HIS . 3.1 m -49.49 -40.37 37.19 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 114.396 -1.274 . . . . 70.27 110.768 171.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 14.0 t -70.89 -24.13 62.42 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.758 -1.11 . . . . 83.83 113.843 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -69.59 -59.08 3.2 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.661 -1.237 . . . . 118.01 107.661 172.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' B' ' 90' ' ' THR . 21.0 t60 -34.22 -64.73 0.23 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.085 -1.871 . . . . 117.41 109.161 171.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 16.4 m -51.61 -40.72 60.38 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 115.632 1.716 . . . . 81.24 115.632 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -74.62 -35.84 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 N-CA-C 116.196 1.924 . . . . 99.12 116.196 -174.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' MSE . . . . . . . . . . . . . 20.3 mtm -69.93 -35.83 74.85 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.247 0.546 . . . . 161.21 110.108 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.14 -37.09 69.5 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.409 -1.269 . . . . 110.27 111.06 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' B' ' 98' ' ' LEU . 3.3 tp -59.81 -60.17 4.26 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.597 0.713 . . . . 97.34 110.422 179.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' MSE . . . . . . . . . . . . . 10.9 mtp -53.32 -46.65 69.54 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.326 -0.852 . . . . 148.98 110.265 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.2 72.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 115.344 -0.844 . . . . 123.1 110.118 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -49.02 73.36 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.389 -0.823 . . . . 103.8 110.693 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.857 HD12 HD12 ' D' ' 102' ' ' LEU . 31.4 tp -55.78 -51.64 66.72 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.131 -0.941 . . . . 97.9 110.221 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -53.47 -50.51 65.17 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 115.239 -0.891 . . . . 124.4 110.812 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.24 56.44 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.524 -0.762 . . . . 111.71 110.411 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' B' ' 106' ' ' LYS . 0.0 OUTLIER -53.03 -50.85 63.41 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.301 -0.863 . . . . 108.92 110.419 179.696 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LYS . . . . . 1.247 ' HD3' ' N ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -53.73 -54.53 36.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.97 0.89 . . . . 139.91 110.677 179.831 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . 1.247 ' N ' ' HD3' ' B' ' 106' ' ' LYS . . . -52.07 -50.11 62.19 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.032 -0.986 . . . . 116.19 110.456 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -54.64 -57.63 10.69 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.394 -0.821 . . . . 134.28 110.632 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLY . . . . . 1.154 ' O ' HG23 ' B' ' 113' ' ' VAL . . . -50.97 -43.89 49.72 Favored Glycine 0 N--CA 1.471 1.009 0 CA-C-N 115.152 -0.931 . . . . 86.55 111.854 179.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -62.17 -57.49 11.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.354 0.597 . . . . 130.23 111.17 179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.16 -21.87 25.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.398 -0.819 . . . . 133.68 110.621 -179.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -107.31 33.86 3.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 116.44 111.569 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' VAL . . . . . 1.154 HG23 ' O ' ' B' ' 109' ' ' GLY . 62.0 t -135.04 -49.19 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 N-CA-C 107.083 -1.451 . . . . 87.8 107.083 -179.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.21 -21.11 65.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.216 -0.902 . . . . 127.64 110.518 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -69.24 -51.14 40.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.571 -0.74 . . . . 111.19 109.24 166.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' B' ' 119' ' ' GLU . 2.3 mt -60.8 -40.9 94.41 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.991 1.108 . . . . 75.29 113.991 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . 0.269 12.2 pt-20 -83.88 -2.05 55.68 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 118.179 -1.408 . . . . 104.43 113.707 -175.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -80.86 -35.31 25.14 Favored Glycine 0 N--CA 1.474 1.173 0 N-CA-C 107.904 -2.078 . . . . 85.85 107.904 168.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 116' ' ' LEU . 4.9 mt-10 -58.9 -53.28 60.13 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 113.925 -1.137 . . . . 90.88 109.613 169.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 mt -55.45 -47.59 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 112.672 0.619 . . . . 64.84 112.672 -174.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 71.0 p -69.66 -44.55 70.29 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 119.771 -0.771 . . . . 80.66 110.416 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 1.9 m -45.77 -51.0 13.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.517 0.511 . . . . 77.78 109.71 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.4 -41.04 98.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.44 -0.8 . . . . 60.96 110.483 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -59.05 -41.03 86.9 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 117.465 -1.694 . . . . 64.32 111.433 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -58.5 -70.87 0.13 Allowed 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.272 -0.876 . . . . 83.74 110.083 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -37.02 -50.0 0.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 120.659 -0.416 . . . . 70.09 111.544 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 28.0 tp -62.52 -45.44 92.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 119.299 -0.96 . . . . 49.44 110.592 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.52 -38.73 60.28 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.538 0.685 . . . . 79.87 109.868 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -75.91 -43.06 47.02 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 113.01 0.745 . . . . 70.25 113.01 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 119.218 -0.993 . . . . 49.5 109.079 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 20.0 m -71.1 -26.13 62.9 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 121.814 0.816 . . . . 51.81 110.079 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.07 -49.38 36.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.683 -1.144 . . . . 59.78 108.583 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLU . . . . . 0.474 ' HA ' ' OE2' ' B' ' 133' ' ' GLU . 0.0 OUTLIER -54.99 -51.86 64.9 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.783 1.278 . . . . 61.49 108.326 177.222 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.05 -46.15 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 O-C-N 121.552 -0.718 . . . . 51.21 110.131 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -40.63 68.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.939 -1.101 . . . . 70.77 111.58 -176.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 14.4 ttp180 -55.12 -42.48 73.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.049 -1.093 . . . . 76.13 108.049 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' B' ' 137' ' ' LEU . 19.3 mt -79.46 -36.66 38.44 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.506 0.928 . . . . 53.05 113.506 -170.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.3 -52.67 62.76 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.623 0.725 . . . . 73.87 110.424 175.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -61.89 -36.46 81.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.696 -1.138 . . . . 77.23 111.425 -177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -75.82 -35.22 60.09 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.177 0.513 . . . . 63.83 111.327 -175.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' D' ' 141' ' ' ASN . 31.2 m-20 -68.62 -39.96 80.59 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.473 -1.24 . . . . 54.67 110.927 -177.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -58.0 -48.75 79.1 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.06 -0.973 . . . . 66.0 111.105 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' VAL . . . . . . . . . . . . . 62.2 t -51.13 -54.5 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.602 -0.888 . . . . 58.68 108.602 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 5.8 mt -56.4 -45.06 80.82 Favored 'General case' 0 C--O 1.209 -1.026 0 CA-C-N 114.191 -1.368 . . . . 55.25 111.487 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -69.6 -29.42 66.94 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 114.618 1.34 . . . . 58.7 114.618 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 44.5 t -73.3 -41.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 108.424 -0.954 . . . . 63.52 108.424 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -60.78 -19.22 58.92 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 113.764 1.024 . . . . 66.85 113.764 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mt -90.74 -35.61 7.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 114.167 -1.379 . . . . 66.68 108.782 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.39 70.31 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.709 -1.132 . . . . 74.84 108.997 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -72.6 -18.21 61.62 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 116.531 2.048 . . . . 78.54 116.531 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 113.822 1.045 . . . . 85.69 113.822 -172.357 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.345 0 CA-C-O 122.513 1.149 . . . . 102.29 109.979 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -56.4 18.58 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.655 -1.611 . . . . 108.17 107.692 170.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -57.38 -26.59 61.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.811 -1.541 . . . . 78.09 113.091 178.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -75.05 -46.88 31.85 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.762 1.393 . . . . 86.8 114.762 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.76 -44.18 81.51 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.884 0.85 . . . . 60.17 111.83 174.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' CYS . . . . . . . . . . . . . 5.9 m -59.76 -58.17 9.71 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.119 -0.491 . . . . 45.3 110.834 171.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -43.47 -52.26 6.17 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 115.119 -0.946 . . . . 67.29 109.238 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -76.3 -44.28 37.7 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 121.227 -0.921 . . . . 60.36 112.8 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' GLY . . . . . 0.473 ' HA3' ' CZ ' ' D' ' 81' ' ' PHE . . . -52.26 -51.59 41.08 Favored Glycine 0 N--CA 1.485 1.939 0 CA-C-N 115.261 -0.881 . . . . 44.62 111.605 170.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.45 HD11 ' HG3' ' D' ' 78' ' ' GLN . 3.2 tp -64.49 -39.59 94.08 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.444 0.64 . . . . 37.04 111.65 -174.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.89 -46.16 88.5 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-O 121.989 0.899 . . . . 85.21 110.472 178.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.03 -52.66 40.91 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.552 -1.204 . . . . 38.79 112.019 173.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 3.0 t -55.33 -46.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.54 -0.755 . . . . 38.36 108.973 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' MSE . . . . . . . . . . . . . 60.4 mmm -66.86 -37.07 83.73 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.358 0.599 . . . . 76.13 110.836 -175.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' C' ' 65' ' ' ASN . 8.2 tp10 -63.36 -36.3 83.24 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.488 -0.778 . . . . 52.35 109.551 177.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' CYS . . . . . . . . . . . . . 73.3 m -69.87 -50.95 37.5 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.709 -0.678 . . . . 36.52 109.487 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -45.24 -54.31 7.18 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 123.056 1.408 . . . . 73.45 111.654 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' C' ' 62' ' ' GLU . 12.2 t30 -45.27 -57.13 4.21 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 124.383 2.039 . . . . 36.57 116.239 172.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . 0.647 HG13 HG13 ' B' ' 66' ' ' VAL . 1.3 t -65.82 -26.12 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 112.822 -1.99 . . . . 30.25 112.762 177.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 34.0 p -71.06 -25.4 62.62 Favored 'General case' 0 CA--C 1.484 -1.574 0 C-N-CA 117.816 -1.554 . . . . 32.13 111.095 174.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -70.35 -38.37 74.82 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 104.738 -2.319 . . . . 41.85 104.738 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.01 -42.13 98.83 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 124.794 1.309 . . . . 33.81 110.679 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -53.93 52.01 Favored 'General case' 0 CA--C 1.476 -1.893 0 CA-C-N 116.377 -0.374 . . . . 33.35 110.778 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -50.66 -44.04 57.53 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 112.806 0.669 . . . . 44.03 112.806 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -61.01 -51.06 70.83 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.769 -1.173 . . . . 43.5 107.97 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -63.85 -42.28 97.6 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.768 -0.651 . . . . 30.81 110.176 -174.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' LEU . . . . . . . . . . . . . 57.6 mt -46.38 -46.82 18.74 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-O 121.871 0.843 . . . . 29.67 113.192 169.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' THR . . . . . 0.722 ' OG1' ' NH2' ' D' ' 64' ' ' ARG . 21.4 m -59.91 -44.42 94.28 Favored 'General case' 0 C--O 1.196 -1.739 0 CA-C-O 118.659 -0.686 . . . . 32.66 110.138 177.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -57.06 -44.08 82.69 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.531 0.605 . . . . 31.16 112.034 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.93 -51.1 68.84 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-O 121.487 0.661 . . . . 22.82 111.144 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' GLN . . . . . 0.824 ' HG3' ' HE1' ' D' ' 61' ' ' MSE . 11.7 tt0 -50.39 -49.05 55.52 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.54 0.686 . . . . 40.41 110.972 175.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -57.61 -44.15 85.25 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.164 -0.925 . . . . 40.01 109.008 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' GLY . . . . . . . . . . . . . . . -45.32 -58.43 5.17 Favored Glycine 0 C--O 1.205 -1.69 0 CA-C-N 113.477 -1.692 . . . . 23.2 110.388 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -70.65 -28.78 65.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 115.091 1.515 . . . . 29.45 115.091 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -71.44 -39.5 70.99 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 119.169 -1.012 . . . . 45.38 109.616 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.49 -46.66 76.88 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.851 1.31 . . . . 59.91 110.033 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 84' ' ' VAL . 2.3 t -67.18 -42.95 88.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.504 -1.295 . . . . 31.1 107.504 -172.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -56.28 -46.26 79.81 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.572 0.953 . . . . 63.73 113.572 175.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -51.64 -62.83 1.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.878 -1.156 . . . . 48.19 107.878 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -46.76 -40.05 12.84 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 114.365 1.246 . . . . 46.1 114.365 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.72 -40.86 75.98 Favored 'General case' 0 C--O 1.2 -1.521 0 CA-C-O 121.281 0.563 . . . . 43.22 110.601 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -52.66 -51.84 58.39 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.164 0.507 . . . . 49.51 111.452 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -55.95 -68.61 0.19 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.329 1.061 . . . . 54.3 109.361 178.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 91' ' ' CYS . 19.5 t -40.03 -39.92 0.96 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.902 -1.045 . . . . 69.23 112.389 174.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.14 -28.86 66.81 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 112.836 0.68 . . . . 78.23 112.836 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -50.27 12.03 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.837 -1.172 . . . . 111.54 107.837 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -45.73 -44.35 13.6 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.812 -0.631 . . . . 58.45 110.181 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -61.04 -61.53 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.594 -1.185 . . . . 57.24 109.934 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' MSE . . . . . . . . . . . . . 65.2 mmm -47.62 -39.85 18.03 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 116.148 -0.478 . . . . 113.53 110.41 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.55 -56.99 13.2 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.873 0.844 . . . . 61.07 112.498 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.38 -41.16 84.17 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 116.019 -0.537 . . . . 58.58 112.372 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' MSE . . . . . . . . . . . . . 6.5 mtt -63.65 -12.15 31.43 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.585 0.587 . . . . 106.35 112.585 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.45 -49.8 5.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.23 -0.656 . . . . 61.61 109.23 178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' SER . . . . . 0.41 ' O ' ' C ' ' C' ' 102' ' ' LEU . 10.5 m -49.91 -65.64 0.53 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.661 0.743 . . . . 58.7 110.097 173.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.41 ' C ' ' O ' ' C' ' 101' ' ' SER . 15.3 tp -32.69 -60.0 0.31 Allowed 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.701 -0.682 . . . . 62.52 111.448 174.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -58.2 -49.84 75.65 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.197 0.999 . . . . 83.87 112.075 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.92 -41.9 68.2 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 120.623 -0.431 . . . . 63.89 109.885 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLU . . . . . 0.517 ' HA ' ' NE2' ' C' ' 108' ' ' GLN . 44.8 tp10 -68.02 -46.85 70.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.813 -0.63 . . . . 73.88 111.465 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -51.46 -39.68 57.94 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.055 -0.975 . . . . 66.77 112.644 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.77 70.15 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.305 0.854 . . . . 68.29 113.305 -176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.517 ' NE2' ' HA ' ' C' ' 105' ' ' GLU . 1.3 mt-30 -78.6 -58.68 3.12 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.123 -0.631 . . . . 85.99 109.411 174.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . -41.46 -57.83 3.11 Favored Glycine 0 C--O 1.208 -1.507 0 N-CA-C 108.58 -1.808 . . . . 56.77 108.58 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -42.27 -55.87 3.16 Favored 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 123.939 0.896 . . . . 97.6 108.923 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -70.46 -55.8 8.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 113.717 -1.583 . . . . 91.24 111.554 -169.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' C' ' 115' ' ' GLU . 9.3 mptt -48.81 -59.67 3.38 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.87 -1.059 . . . . 74.34 111.749 178.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' VAL . . . . . . . . . . . . . 1.3 t -44.28 -46.32 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.29 0.636 . . . . 50.65 112.141 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.82 -50.79 72.03 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 107.779 -1.193 . . . . 95.32 107.779 -176.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' C' ' 112' ' ' LYS . 2.3 tt0 -38.17 -70.95 0.09 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.693 1.197 . . . . 78.02 113.469 172.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.07 -37.9 78.17 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.338 -1.301 . . . . 50.98 111.975 -177.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -62.47 -24.88 67.69 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.433 -0.907 . . . . 69.71 112.441 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.45 -43.87 14.56 Favored Glycine 0 C--O 1.222 -0.626 0 N-CA-C 110.935 -0.866 . . . . 55.8 110.935 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -55.26 -43.72 74.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.947 -0.76 . . . . 61.29 108.947 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ILE . . . . . 0.661 HD12 HG13 ' A' ' 120' ' ' ILE . 1.4 mp -55.02 -50.66 61.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 CA-C-N 115.515 -0.766 . . . . 45.47 111.135 174.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' THR . . . . . . . . . . . . . 65.0 m -64.2 -40.03 95.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.155 -1.018 . . . . 59.33 111.732 -172.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.79 -35.05 67.3 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.477 0.656 . . . . 63.47 111.103 -173.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 24.7 mt -62.7 -44.85 95.18 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.614 -1.175 . . . . 45.52 108.903 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.28 -39.19 75.18 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.324 -0.95 . . . . 52.5 113.201 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' HIS . . . . . 0.49 ' HA ' ' OE1' ' C' ' 128' ' ' GLN . 65.1 m170 -72.63 -45.48 58.8 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.015 -0.993 . . . . 69.14 109.454 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -58.12 -40.0 80.13 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.885 -1.052 . . . . 57.6 109.766 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' LEU . . . . . . . . . . . . . 20.3 tp -59.83 -44.58 93.98 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 119.784 -0.766 . . . . 39.66 110.708 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' GLN . . . . . 0.49 ' OE1' ' HA ' ' C' ' 125' ' ' HIS . 19.8 mt-30 -63.15 -46.44 87.17 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.851 -0.613 . . . . 56.25 111.902 177.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -50.93 -35.89 35.72 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 114.556 1.317 . . . . 66.38 114.556 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -85.59 -42.22 14.55 Favored 'General case' 0 CA--C 1.491 -1.298 0 N-CA-C 107.242 -1.392 . . . . 44.0 107.242 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' SER . . . . . . . . . . . . . 16.8 m -57.04 -30.71 64.46 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.247 -0.888 . . . . 43.36 110.843 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -63.95 0.96 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 114.817 -1.083 . . . . 52.01 109.756 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -50.22 -29.27 9.09 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.061 -0.972 . . . . 60.74 110.732 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' VAL . . . . . . . . . . . . . 5.4 t -65.26 -57.31 11.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.508 -0.923 . . . . 44.29 108.508 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' GLU . . . . . 0.597 ' HA ' ' OE1' ' C' ' 135' ' ' GLU . 0.2 OUTLIER -39.14 -50.41 1.88 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 125.658 1.849 . . . . 57.54 115.702 172.123 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' ARG . . . . . . . . . . . . . 59.2 ttp85 -47.48 -45.68 26.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.238 -1.347 . . . . 83.01 108.005 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 18.7 mt -86.75 -40.66 14.8 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 114.036 1.125 . . . . 47.44 114.036 -167.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -53.1 -34.21 55.65 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 117.807 -1.557 . . . . 59.62 109.002 170.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' ARG . . . . . . . . . . . . . 32.2 mtm-85 -63.54 -66.05 0.6 Allowed 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.028 -0.73 . . . . 69.71 109.028 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -41.48 -44.75 3.01 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 113.383 0.883 . . . . 65.44 113.383 169.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.43 -57.99 10.57 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.574 0.702 . . . . 66.1 112.152 -175.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -56.89 -47.74 79.78 Favored 'General case' 0 CA--C 1.556 1.2 0 CA-C-N 114.126 -1.397 . . . . 72.85 111.053 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.7 -61.47 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 113.994 -1.457 . . . . 57.59 109.796 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.29 -37.63 78.16 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.365 -0.534 . . . . 48.97 112.314 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' SER . . . . . . . . . . . . . 3.0 p -68.13 -27.99 66.93 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 121.722 0.772 . . . . 46.02 111.348 -175.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.85 -50.08 35.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 CA-C-O 122.421 1.105 . . . . 59.5 108.904 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -48.37 -38.72 20.08 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.862 -0.735 . . . . 73.47 110.468 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' ILE . . . . . . . . . . . . . 47.0 mt -68.11 -45.16 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 CA-C-O 121.607 0.718 . . . . 49.33 112.106 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' ALA . . . . . . . . . . . . . . . -51.28 -54.21 28.17 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.058 -0.973 . . . . 57.48 110.798 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -45.27 -55.41 5.92 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.974 1.101 . . . . 73.82 113.974 174.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.968 0 CA-C-N 115.021 -0.991 . . . . 81.4 111.547 -166.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.514 2.726 0 N-CA-C 113.099 0.777 . . . . 67.63 113.099 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -32.67 74.5 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 115.097 -0.956 . . . . 100.62 113.006 170.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' ALA . . . . . 0.498 ' CB ' HG23 ' A' ' 84' ' ' VAL . . . -59.37 -41.94 90.46 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 113.278 0.844 . . . . 62.86 113.278 -179.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' CYS . . . . . 0.473 ' SG ' HG12 ' C' ' 84' ' ' VAL . 50.9 m -58.73 -53.02 63.04 Favored 'General case' 0 C--O 1.2 -1.514 0 O-C-N 120.973 -1.079 . . . . 47.79 110.409 176.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -54.42 -52.49 61.61 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 113.641 -1.618 . . . . 113.25 108.685 -174.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.7 -43.18 85.07 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.661 -0.7 . . . . 60.02 111.884 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.12 98.02 Favored Glycine 0 C--O 1.206 -1.595 0 N-CA-C 110.232 -1.147 . . . . 39.9 110.232 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.33 -39.99 89.6 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 107.109 -1.441 . . . . 30.82 107.109 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' ARG . . . . . 0.473 ' HD3' ' O ' ' D' ' 2' ' ' HOH . 3.0 ttp180 -60.36 -52.68 64.22 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.43 -0.908 . . . . 43.42 109.097 -177.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.0 -39.04 68.63 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 119.786 -0.766 . . . . 37.17 111.084 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.81 -50.9 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 119.2 -1.0 . . . . 34.84 110.402 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' MSE . . . . . 0.824 ' HE1' ' HG3' ' C' ' 78' ' ' GLN . 28.0 mmt -55.33 -38.75 69.13 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.507 -0.923 . . . . 65.96 108.507 178.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -67.0 -40.72 87.39 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 118.607 -1.237 . . . . 47.63 111.25 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' CYS . . . . . . . . . . . . . 81.5 m -58.86 -34.9 72.11 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 120.41 -1.431 . . . . 36.93 109.846 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' ARG . . . . . 0.722 ' NH2' ' OG1' ' C' ' 75' ' ' THR . 25.2 ttm-85 -63.91 -50.17 69.77 Favored 'General case' 0 C--N 1.278 -2.519 0 CA-C-N 114.258 -1.337 . . . . 45.32 107.58 -177.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -56.87 -42.68 80.23 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-O 122.175 0.988 . . . . 30.21 113.029 178.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 83.7 t -70.37 -46.55 70.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 112.949 -1.932 . . . . 31.67 110.765 -177.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' THR . . . . . . . . . . . . . 98.2 m -60.09 -34.14 73.06 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.703 -1.142 . . . . 30.13 112.156 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -62.27 -34.14 75.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 116.737 -1.985 . . . . 33.93 111.258 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 14.7 tp -73.47 -40.77 63.89 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.531 1.158 . . . . 33.01 107.975 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' LEU . . . . . . . . . . . . . 8.5 tp -50.9 -52.68 39.6 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 114.243 -1.344 . . . . 32.13 112.188 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -53.19 -43.4 67.13 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.843 1.423 . . . . 36.81 114.843 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -66.3 -39.28 89.22 Favored 'General case' 0 C--O 1.26 1.611 0 C-N-CA 119.818 -0.753 . . . . 35.9 112.295 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -73.0 -36.37 67.03 Favored 'General case' 0 C--O 1.205 -1.249 0 C-N-CA 118.626 -1.23 . . . . 33.81 110.461 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' LEU . . . . . . . . . . . . . 49.9 mt -59.85 -38.66 82.72 Favored 'General case' 0 C--O 1.254 1.308 0 N-CA-C 113.102 0.778 . . . . 31.82 113.102 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 54.4 m -63.61 -41.14 98.33 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 122.684 1.23 . . . . 34.32 108.09 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -65.13 -34.28 78.03 Favored 'General case' 0 C--O 1.193 -1.908 0 CA-C-N 114.653 -1.158 . . . . 34.92 112.718 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.07 84.08 Favored 'General case' 0 C--O 1.19 -2.071 0 O-C-N 119.935 -1.728 . . . . 27.43 113.04 170.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' GLN . . . . . 0.45 ' HG3' HD11 ' C' ' 57' ' ' LEU . 63.8 tt0 -50.54 -42.05 54.73 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 107.87 -1.159 . . . . 45.0 107.87 173.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -61.93 -46.46 89.23 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 112.862 0.69 . . . . 43.44 112.862 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' GLY . . . . . . . . . . . . . . . -49.64 -51.57 27.64 Favored Glycine 0 N--CA 1.479 1.549 0 CA-C-N 115.786 -0.643 . . . . 27.37 112.336 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' PHE . . . . . 0.473 ' CZ ' ' HA3' ' C' ' 56' ' ' GLY . 13.4 m-85 -65.47 -28.59 69.32 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 112.676 0.621 . . . . 36.18 112.676 -173.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -80.72 -43.05 20.88 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.197 -1.001 . . . . 47.27 110.092 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.58 -35.45 72.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 118.753 -1.179 . . . . 38.54 109.515 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' VAL . . . . . 0.534 HG11 HG11 ' B' ' 84' ' ' VAL . 1.8 t -72.2 -49.78 40.87 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 O-C-N 121.419 -0.8 . . . . 34.04 112.776 -176.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -47.09 -37.31 9.42 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.77 1.228 . . . . 54.4 112.674 169.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.43 -38.01 83.92 Favored 'General case' 0 C--O 1.198 -1.609 0 N-CA-C 108.619 -0.882 . . . . 44.99 108.619 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.55 -40.62 25.57 Favored 'General case' 0 C--O 1.21 -1.016 0 O-C-N 124.113 0.883 . . . . 74.59 113.208 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.65 -28.06 8.16 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 106.737 -1.579 . . . . 48.94 106.737 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.27 9.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 118.325 -1.35 . . . . 50.88 109.879 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' THR . . . . . . . . . . . . . 60.6 m -46.64 -47.91 20.05 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 104.797 -2.297 . . . . 53.61 104.797 176.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' CYS . . . . . . . . . . . . . 57.5 m -70.01 -50.22 43.67 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.962 1.467 . . . . 60.06 114.962 -172.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -54.33 -56.44 18.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.783 0.801 . . . . 79.07 108.918 176.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -40.24 -58.15 1.56 Allowed 'General case' 0 C--O 1.212 -0.879 0 CA-C-N 114.967 -1.015 . . . . 65.2 109.998 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 24.0 m -51.67 -63.89 0.99 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 119.781 -0.767 . . . . 62.9 109.325 -174.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' VAL . . . . . 0.441 HG12 ' N ' ' D' ' 96' ' ' MSE . 1.8 t -39.99 -55.77 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.638 0.775 . . . . 63.65 112.187 174.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' MSE . . . . . 0.441 ' N ' HG12 ' D' ' 95' ' ' VAL . 0.0 OUTLIER -51.66 -47.13 63.92 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.083 -0.962 . . . . 116.78 110.414 -179.04 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.24 -35.5 67.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.248 0.619 . . . . 67.61 111.956 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.87 -50.07 12.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.251 -0.886 . . . . 74.76 112.179 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' MSE . . . . . . . . . . . . . 91.6 mtp -45.72 -46.13 14.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.643 -0.708 . . . . 120.39 109.322 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.21 98.78 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 114.811 -1.086 . . . . 76.99 110.38 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -35.55 81.5 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 122.181 0.991 . . . . 66.17 112.212 179.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' LEU . . . . . 0.857 HD12 HD12 ' B' ' 102' ' ' LEU . 10.5 tp -68.14 -61.9 1.64 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.134 -0.939 . . . . 70.87 110.109 176.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -44.2 -35.21 2.14 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 115.106 1.521 . . . . 91.69 115.106 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.44 -26.8 46.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 109.054 -0.721 . . . . 76.87 109.054 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -69.81 -35.3 74.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.35 -1.295 . . . . 77.33 111.125 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -66.95 -35.35 79.78 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.801 -0.636 . . . . 97.4 110.552 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.55 -23.98 58.86 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 114.328 -1.305 . . . . 85.45 111.454 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -83.08 -33.03 26.48 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.353 1.033 . . . . 85.64 108.46 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.15 -52.43 5.68 Favored Glycine 0 C--O 1.21 -1.373 0 CA-C-N 115.293 -0.867 . . . . 72.62 113.916 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.99 -7.6 59.62 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.116 0.413 . . . . 98.09 112.116 -175.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' D' ' 115' ' ' GLU . 44.1 tttt -93.67 -34.64 13.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.57 -0.741 . . . . 109.27 110.157 172.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -69.37 -54.76 12.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.831 -0.803 . . . . 92.84 108.831 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.91 -52.92 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.359 1.064 . . . . 69.47 112.256 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -88.38 -1.96 58.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.855 -1.066 . . . . 118.89 110.866 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' D' ' 111' ' ' LYS . 0.0 OUTLIER -86.23 -29.37 23.2 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.717 -1.216 . . . . 106.69 107.717 167.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' LEU . . . . . 0.407 HD13 ' HG2' ' D' ' 115' ' ' GLU . 0.1 OUTLIER -94.02 -12.01 29.54 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.213 -1.358 . . . . 96.8 113.522 178.786 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' GLU . . . . . 0.697 ' HA ' HG12 ' D' ' 120' ' ' ILE . 52.1 mt-10 -90.76 -27.56 18.84 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 121.699 0.761 . . . . 84.99 111.954 173.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.62 9.78 41.4 Favored Glycine 0 N--CA 1.471 1.003 0 N-CA-C 109.288 -1.525 . . . . 85.5 109.288 168.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.4 -34.4 6.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 113.945 -1.127 . . . . 84.96 109.326 169.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' ILE . . . . . 0.697 HG12 ' HA ' ' D' ' 117' ' ' GLU . 36.3 mm -54.91 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.836 0 N-CA-C 108.082 -1.081 . . . . 65.85 108.082 171.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' THR . . . . . 0.414 ' HA ' ' HB2' ' D' ' 124' ' ' ASN . 55.4 p -54.99 -31.4 60.94 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.621 -1.172 . . . . 79.97 110.151 -170.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -16.68 61.26 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.629 0.974 . . . . 84.78 113.629 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.39 -39.91 12.39 Favored 'General case' 0 C--O 1.216 -0.68 0 N-CA-C 108.26 -1.015 . . . . 70.45 108.26 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' ASN . . . . . 0.414 ' HB2' ' HA ' ' D' ' 121' ' ' THR . 1.7 m-20 -51.85 -53.28 42.23 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.944 1.831 . . . . 66.48 115.944 174.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' HIS . . . . . 0.44 ' HA ' ' OE1' ' D' ' 128' ' ' GLN . 60.7 m170 -51.19 -43.89 61.43 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.987 -0.551 . . . . 87.98 110.869 173.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -60.8 -41.32 95.43 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.551 0.574 . . . . 72.88 112.551 176.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' LEU . . . . . . . . . . . . . 17.2 tp -61.29 -62.39 1.87 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.469 -0.787 . . . . 57.07 109.617 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' D' ' 125' ' ' HIS . 59.8 mt-30 -43.26 -39.26 2.93 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 112.939 0.718 . . . . 84.24 112.939 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.06 -44.61 12.87 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.797 -0.638 . . . . 82.82 111.361 -170.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.1 -27.31 67.24 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.595 -0.73 . . . . 60.99 110.192 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' SER . . . . . . . . . . . . . 12.1 p -91.7 -1.66 57.33 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 117.301 -1.76 . . . . 60.7 112.635 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.47 37.42 Favored 'General case' 0 CA--C 1.489 -1.402 0 N-CA-C 105.558 -2.016 . . . . 71.3 105.558 168.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -68.38 -29.83 68.63 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.993 -1.458 . . . . 74.08 111.596 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' VAL . . . . . 0.442 HG22 ' HB3' ' B' ' 133' ' ' GLU . 7.1 t -67.69 -47.74 78.81 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.685 -0.806 . . . . 58.2 109.307 174.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -59.37 -36.47 75.82 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 114.299 1.222 . . . . 85.16 114.299 174.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -59.25 -61.4 2.66 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 108.282 -1.007 . . . . 85.1 108.282 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.31 -34.93 76.05 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.33 -1.759 . . . . 62.95 113.259 -172.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 10.3 ttp85 -63.31 -59.53 4.59 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 120.967 0.413 . . . . 95.96 111.599 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' ARG . . . . . . . . . . . . . 36.4 mtm-85 -48.79 -43.36 37.98 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.503 -0.748 . . . . 97.91 110.731 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.93 -27.9 62.13 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.407 0.891 . . . . 90.02 113.407 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' B' ' 141' ' ' ASN . 0.5 OUTLIER -67.29 -45.38 76.74 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.595 -0.442 . . . . 73.16 110.932 170.226 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -64.94 -32.93 74.88 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 116.036 -0.529 . . . . 77.64 111.848 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' VAL . . . . . . . . . . . . . 5.1 t -60.16 -63.22 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.467 -1.309 . . . . 78.07 107.467 173.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 16.9 mt -52.2 -40.19 61.22 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 115.372 -0.831 . . . . 64.65 112.718 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' SER . . . . . . . . . . . . . 2.9 m -59.54 -30.23 68.46 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.063 0.458 . . . . 63.97 111.726 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -89.72 -31.94 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 CA-C-N 114.86 -1.064 . . . . 79.84 110.82 -172.466 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 147' ' ' ARG . . . . . . . . . . . . . 50.2 mtp180 -61.99 -28.52 69.62 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 115.906 -0.588 . . . . 87.94 112.044 165.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 148' ' ' ILE . . . . . . . . . . . . . 1.4 mm -69.24 -59.11 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 109.463 -0.569 . . . . 73.38 109.463 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 149' ' ' ALA . . . . . . . . . . . . . . . -59.65 -24.54 63.95 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 113.961 1.097 . . . . 81.65 113.961 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 N--CA 1.495 1.821 0 C-N-CA 123.715 0.806 . . . . 100.45 111.45 177.139 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . 0.811 ' O ' ' HD3' ' B' ' 64' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . 0.573 ' O ' ' HG3' ' A' ' 76' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' HOH . . . . . 0.893 ' O ' HD23 ' B' ' 69' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' HOH . . . . . 0.456 ' O ' ' HG2' ' B' ' 79' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' HOH . . . . . 0.473 ' O ' ' HD3' ' D' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_