data_3cs5_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 3cs5 _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 ' 12' ' ' VAL . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' GLN . 54.9 t . . . . . 0 C--O 1.239 0.539 0 CA-C-O 117.339 -1.315 . . . . 24.129999999999999 109.572 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . 0.465 ' O ' ' N ' ' A' ' 16' ' ' PHE . 2.7 mt-10 -34.4 -67.16 0.14 Allowed 'General case' 0 C--N 1.321 -0.664 0 O-C-N 127.461 2.975 . . . . 28.059999999999999 112.16 -175.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -43.82 -36.13 2.2 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 125.09 1.494 . . . . 27.629999999999999 111.31 175.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 12' ' ' VAL . 26.2 mt-30 -61.7 -32.96 73.19 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 121.135 -0.978 . . . . 16.890000000000001 109.446 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . 0.465 ' N ' ' O ' ' A' ' 13' ' ' GLU . 6.0 m-85 -62.17 -56.72 15.95 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.577 -1.638 . . . . 29.800000000000001 106.577 170.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.42 -60.95 0.47 Allowed 'General case' 0 C--N 1.322 -0.614 0 O-C-N 126.909 2.63 . . . . 60.43 109.176 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 mt -45.72 -60.52 2.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 124.62 2.152 . . . . 22.75 113.563 175.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -57.55 -41.47 81.04 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 113.584 -1.644 . . . . 33.899999999999999 109.144 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.93 -45.0 94.0 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 126.363 2.289 . . . . 30.66 110.469 176.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -69.88 -7.94 44.43 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.029 -1.67 . . . . 28.68 111.214 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -77.37 -54.16 6.8 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.074 -1.016 . . . . 19.239999999999998 111.192 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLN . . . . . 0.488 ' O ' ' OD2' ' A' ' 27' ' ' ASP . 4.4 mt-30 -45.21 -52.62 9.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.767 1.27 . . . . 16.879999999999999 112.398 179.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -52.02 -27.85 15.02 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 112.709 -2.042 . . . . 37.439999999999998 111.821 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.0 t -109.5 -11.88 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 128.134 2.574 . . . . 10.74 114.346 -166.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -99.99 15.71 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 123.425 0.69 . . . . 28.32 109.694 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . 0.488 ' OD2' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -127.36 -29.31 2.72 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 126.935 2.094 . . . . 17.48 108.846 169.632 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -60.34 141.14 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 119.345 -0.942 . . . . 52.490000000000002 109.156 -177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' SER . . . . . 0.443 ' O ' ' N ' ' A' ' 33' ' ' LEU . 77.8 p -76.33 173.97 10.78 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 126.288 2.242 . . . . 27.460000000000001 113.837 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -45.6 -81.48 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 127.223 2.209 . . . . 46.810000000000002 113.617 -178.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -42.53 94.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 118.376 -1.33 . . . . 34.229999999999997 108.454 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.78 -8.19 20.06 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.064 0.852 . . . . 46.670000000000002 112.742 -178.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 29' ' ' SER . 10.2 tp -106.43 11.3 30.96 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.378 -0.826 . . . . 62.969999999999999 108.782 170.37 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -105.05 -37.73 6.84 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 113.14 0.793 . . . . 25.75 113.14 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -74.44 -12.49 60.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.675 1.226 . . . . 41.93 111.807 -175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 mt -100.17 20.21 15.02 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 115.767 -2.373 . . . . 24.23 107.459 173.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . 0.45 ' CE1' ' O ' ' B' ' 36' ' ' LEU . 45.6 t80 -119.34 -12.95 9.32 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 117.445 -1.702 . . . . 32.210000000000001 108.676 170.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 pt -89.77 -35.38 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.879 -1.055 . . . . 46.509999999999998 110.635 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -73.38 -18.63 61.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 123.506 1.622 . . . . 43.509999999999998 111.471 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . 0.455 ' O ' ' N ' ' A' ' 43' ' ' GLN . 4.0 t -84.01 -53.24 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 113.636 -1.62 . . . . 63.450000000000003 115.028 -175.37 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -10.52 12.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 114.402 -1.272 . . . . 34.560000000000002 110.456 174.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . 0.884 ' CZ ' ' NH2' ' B' ' 22' ' ' ARG . 37.4 mtt85 -74.85 -50.2 17.89 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 124.008 0.818 . . . . 40.579999999999998 111.135 151.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . 0.455 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -44.48 -80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 27.57 111.189 -179.519 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.31 -45.22 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.363 2.265 . . . . 34.090000000000003 113.133 178.909 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.0 mmm -68.39 -37.73 80.66 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.044 -0.41 . . . . 27.420000000000002 111.885 -175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.29 -30.7 40.16 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.192 1.397 . . . . 18.329999999999998 111.132 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . 0.461 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.1 m80 -80.52 -34.83 35.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.193 -1.367 . . . . 25.09 109.054 172.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -51.89 -49.22 63.45 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 124.242 0.964 . . . . 39.670000000000002 110.194 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -67.47 -9.67 44.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.875 2.87 . . . . 26.390000000000001 112.366 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 54' ' ' MET . 0.0 OUTLIER -101.5 -48.42 11.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.712 -1.585 . . . . 61.329999999999998 109.736 -172.801 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ILE . 39.8 t80 -60.72 -53.91 51.65 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 117.868 -1.533 . . . . 35.829999999999998 108.782 169.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -43.12 -58.28 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 125.432 1.707 . . . . 35.950000000000003 109.103 171.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -48.41 -42.23 25.78 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 114.438 -1.255 . . . . 56.299999999999997 110.158 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -72.56 -30.85 64.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.761 0.824 . . . . 38.090000000000003 112.159 -178.238 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . 0.526 ' N ' ' O ' ' A' ' 51' ' ' PHE . 0.0 OUTLIER -89.99 -18.15 7.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 118.03 -1.468 . . . . 30.559999999999999 110.184 -179.359 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.33 70.52 0.76 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 116.02 -2.272 . . . . 12.06 108.968 171.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -19.73 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 128.041 2.536 . . . . 28.149999999999999 108.932 -163.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.42 -31.8 6.63 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 109.524 -3.489 . . . . 27.350000000000001 111.802 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-O 120.788 0.328 . . . . 29.0 111.213 -179.835 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-O 121.131 0.491 . . . . 8.4000000000000004 109.862 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -50.97 -38.04 48.41 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.954 1.302 . . . . 39.57 112.427 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -61.04 -55.43 32.83 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 125.369 1.668 . . . . 24.52 109.103 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -45.69 -48.82 15.03 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 126.651 2.47 . . . . 20.190000000000001 108.865 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -50.78 -51.31 51.78 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.486 2.991 . . . . 27.699999999999999 109.985 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' B' ' 20' ' ' LYS . 0.1 OUTLIER -56.8 -63.35 1.23 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.551 1.14 . . . . 31.219999999999999 111.302 -179.042 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . 0.545 ' O ' ' CG ' ' B' ' 22' ' ' ARG . 0.3 OUTLIER -45.39 -38.81 6.29 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 124.394 1.059 . . . . 33.689999999999998 111.569 -175.351 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLN . . . . . 0.487 ' O ' ' N ' ' B' ' 23' ' ' GLN . 36.8 mt-30 -64.94 -37.11 86.55 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 128.029 2.532 . . . . 36.770000000000003 112.338 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' B' ' 17' ' ' ASP . 0.0 OUTLIER -75.34 -17.8 60.15 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 122.591 1.186 . . . . 44.460000000000001 110.567 177.689 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' TYR . . . . . 0.45 ' O ' ' N ' ' B' ' 25' ' ' VAL . 1.5 m-85 -89.9 -25.96 20.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.11 -0.95 . . . . 40.82 111.224 -179.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . 0.884 ' NH2' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -91.97 -22.65 19.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 50.060000000000002 111.186 167.191 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLN . . . . . 0.487 ' N ' ' O ' ' B' ' 19' ' ' GLN . 0.5 OUTLIER -55.37 -47.47 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 31.920000000000002 111.179 157.748 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLN . . . . . 0.603 ' O ' ' N ' ' B' ' 26' ' ' ARG . 52.8 mt-30 -70.6 -86.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 30.210000000000001 111.223 166.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' B' ' 28' ' ' ILE . 1.3 t -19.49 -58.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.462 . . . . 35.630000000000003 111.207 -159.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' B' ' 24' ' ' GLN . 3.9 mtt85 -25.8 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 48.979999999999997 111.208 177.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . 0.624 ' N ' ' O ' ' B' ' 25' ' ' VAL . 2.9 m-20 -89.83 -6.43 55.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 18.359999999999999 111.166 -169.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ILE . . . . . 0.628 ' N ' ' O ' ' B' ' 25' ' ' VAL . 1.5 mt -87.55 -163.72 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 36.939999999999998 111.222 -170.437 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' SER . . . . . 0.475 ' N ' ' CG2' ' B' ' 28' ' ' ILE . 1.3 p -146.06 147.46 31.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 30.199999999999999 111.236 -156.25 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -37.94 -44.8 0.81 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 114.079 1.14 . . . . 42.119999999999997 114.079 -171.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.9 -28.29 16.57 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.24 0.459 . . . . 42.850000000000001 112.24 -176.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.34 -20.34 60.13 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 118.675 -1.21 . . . . 65.209999999999994 110.854 -179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' B' ' 37' ' ' PHE . 9.0 mt -92.46 -29.77 16.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.018 -0.991 . . . . 49.590000000000003 109.219 168.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . 0.461 ' O ' ' N ' ' B' ' 38' ' ' ILE . 0.1 OUTLIER -51.79 -64.07 0.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 127.26 2.85 . . . . 30.969999999999999 107.541 173.8 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' B' ' 39' ' ' GLU . 13.6 m-20 -59.16 -43.87 92.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 125.601 1.813 . . . . 43.950000000000003 112.315 178.494 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . 0.45 ' O ' ' CE1' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -63.93 -26.9 68.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.439 -0.905 . . . . 48.869999999999997 108.789 178.881 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PHE . . . . . 0.636 ' O ' ' CG2' ' B' ' 40' ' ' VAL . 86.2 t80 -82.0 -49.02 10.73 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 122.912 1.339 . . . . 61.259999999999998 111.365 175.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . 0.461 ' N ' ' O ' ' B' ' 34' ' ' GLU . 6.2 pt -57.7 -35.58 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 119.193 -2.192 . . . . 28.789999999999999 108.744 175.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' B' ' 35' ' ' ASP . 97.8 mt-10 -68.83 -30.67 69.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 113.568 -1.651 . . . . 24.98 107.71 179.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' VAL . . . . . 0.94 ' CG2' ' N ' ' B' ' 41' ' ' VAL . 3.3 m -45.68 -69.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 125.855 1.972 . . . . 33.549999999999997 110.419 176.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . 0.94 ' N ' ' CG2' ' B' ' 40' ' ' VAL . 4.0 t -70.79 -15.18 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.69 0 O-C-N 126.369 2.293 . . . . 42.130000000000003 109.942 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.61 -9.41 58.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.178 -0.919 . . . . 43.710000000000001 109.902 174.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -112.26 -49.79 2.94 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.316 0.858 . . . . 50.82 113.316 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -7.48 23.94 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 113.327 0.862 . . . . 26.57 113.327 -173.049 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' MET . . . . . 0.449 ' O ' ' ND2' ' B' ' 49' ' ' ASN . 95.1 mmm -79.65 -37.92 34.91 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.888 -1.153 . . . . 31.52 107.888 171.018 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.31 67.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 113.812 -1.54 . . . . 30.579999999999998 108.915 167.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -82.57 0.8 41.11 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.714 1.259 . . . . 22.010000000000002 109.431 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLU . . . . . 0.461 ' O ' ' N ' ' B' ' 52' ' ' LYS . 11.5 mt-10 -108.89 -40.15 5.11 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.811 1.944 . . . . 65.319999999999993 110.711 169.788 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASN . . . . . 0.449 ' ND2' ' O ' ' B' ' 45' ' ' MET . 6.6 m-80 -68.66 -43.8 75.44 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 118.018 -1.473 . . . . 19.48 109.286 178.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -3.73 4.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 C-N-CA 124.557 1.143 . . . . 73.459999999999994 110.404 177.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -113.25 -3.24 13.89 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.109 1.363 . . . . 40.689999999999998 110.483 172.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . 0.461 ' N ' ' O ' ' B' ' 48' ' ' GLU . 10.7 mttt -102.47 -18.85 15.15 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 124.978 1.311 . . . . 32.090000000000003 108.938 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.52 -47.5 5.38 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 108.678 -1.769 . . . . 26.420000000000002 108.678 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 30.8 mmm -58.59 -22.73 56.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.944 -0.628 . . . . 33.509999999999998 111.991 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -96.24 -12.44 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 114.139 -3.024 . . . . 27.66 107.436 174.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.17 -26.49 28.23 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.155 -0.93 . . . . 58.850000000000001 111.347 176.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.39 26.87 0.36 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.799 1.182 . . . . 26.829999999999998 113.322 -176.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . 0.498 ' O ' ' OE1' ' C' ' 48' ' ' GLU . . . -82.5 54.0 4.86 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.324 -1.111 . . . . 30.899999999999999 110.324 175.788 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 99.0 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.817 0.341 . . . . 40.960000000000001 111.221 176.546 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' VAL . . . . . 0.477 ' N ' ' OE1' ' C' ' 15' ' ' GLN . 1.2 t . . . . . 0 CA--C 1.519 -0.238 0 N-CA-C 110.281 -0.266 . . . . 47.659999999999997 110.281 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -84.95 14.85 4.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.354 -0.384 . . . . 61.399999999999999 111.169 166.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' C' ' 17' ' ' ASP . 0.0 OUTLIER -105.82 -54.49 2.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 38.609999999999999 111.182 143.912 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLN . . . . . 0.477 ' OE1' ' N ' ' C' ' 12' ' ' VAL . 4.5 mt-30 -53.7 -30.53 44.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.298 1.047 . . . . 46.880000000000003 111.778 -175.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' C' ' 12' ' ' VAL . 4.9 m-30 -67.64 -24.51 65.46 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.326 -1.361 . . . . 26.309999999999999 107.326 175.338 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' C' ' 14' ' ' GLN . 57.1 m-20 -81.79 -45.77 15.14 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 117.859 -1.067 . . . . 38.520000000000003 111.134 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mt -51.72 -58.42 6.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 118.747 0.703 . . . . 37.380000000000003 110.85 -178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -48.09 -40.87 24.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.845 0.831 . . . . 34.119999999999997 110.637 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -46.29 -67.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 113.075 -1.875 . . . . 35.979999999999997 110.934 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' TYR . . . . . 0.454 ' O ' ' N ' ' C' ' 24' ' ' GLN . 0.0 OUTLIER -59.16 -34.39 72.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.513 2.325 . . . . 48.109999999999999 111.152 -176.391 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -67.37 -6.44 18.95 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.053 -0.522 . . . . 27.800000000000001 111.701 -175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -74.79 -54.45 7.31 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.467 2.307 . . . . 23.100000000000001 109.89 157.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' C' ' 21' ' ' TYR . 8.1 mt-30 -51.67 -70.58 0.08 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.355 -1.293 . . . . 30.84 111.038 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' VAL . . . . . 1.013 ' CG1' ' CD2' ' C' ' 33' ' ' LEU . 0.0 OUTLIER -44.29 -58.64 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 125.606 1.816 . . . . 37.850000000000001 109.496 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -43.06 -31.83 0.6 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 113.714 -1.584 . . . . 76.060000000000002 113.065 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -103.48 -17.28 15.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.181 1.393 . . . . 25.98 114.186 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ILE . . . . . 1.054 ' CG2' ' CG ' ' C' ' 33' ' ' LEU . 13.7 tt -73.66 169.93 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-O 122.651 1.215 . . . . 44.670000000000002 112.305 -177.66 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' SER . . . . . 0.455 ' OG ' ' N ' ' C' ' 32' ' ' ASP . 0.9 OUTLIER -86.11 -177.2 6.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.176 1.917 . . . . 38.240000000000002 116.176 -167.286 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.85 -28.23 63.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 112.324 -2.217 . . . . 44.829999999999998 110.603 176.306 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.15 -33.59 9.15 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.372 -0.831 . . . . 16.32 112.352 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ASP . . . . . 0.476 ' O ' ' CD1' ' C' ' 28' ' ' ILE . 11.2 m-20 -78.56 -26.15 45.53 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 130.649 3.579 . . . . 17.510000000000002 113.344 -171.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' LEU . . . . . 1.054 ' CG ' ' CG2' ' C' ' 28' ' ' ILE . 6.8 mt -84.43 -16.09 43.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 117.196 -1.802 . . . . 45.170000000000002 107.59 169.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' GLU . . . . . 0.455 ' O ' ' CG1' ' D' ' 25' ' ' VAL . 13.4 mt-10 -72.58 -53.73 11.11 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 114.592 -1.185 . . . . 68.730000000000004 112.704 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -81.65 15.51 2.11 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 118.92 -2.362 . . . . 53.890000000000001 111.179 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 3.2 mt -94.44 -41.46 9.37 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.896 1.279 . . . . 35.520000000000003 110.603 172.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' PHE . . . . . 1.086 ' CE2' ' CD2' ' D' ' 33' ' ' LEU . 18.7 m-30 -58.7 -47.03 85.93 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 117.659 -1.616 . . . . 53.700000000000003 109.267 172.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' ILE . . . . . 0.711 ' CD1' ' NH1' ' D' ' 22' ' ' ARG . 0.5 OUTLIER -49.72 -33.81 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 125.656 1.848 . . . . 30.600000000000001 111.498 174.6 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.06 -81.42 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 126.189 2.181 . . . . 48.850000000000001 110.061 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' VAL . . . . . 0.763 ' CG2' ' NZ ' ' D' ' 44' ' ' LYS . 19.0 t -60.74 -13.58 7.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-N 115.747 -0.66 . . . . 41.039999999999999 112.505 -178.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' VAL . . . . . . . . . . . . . 93.7 t -68.49 -37.7 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 112.569 -3.653 . . . . 64.959999999999994 107.401 173.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ARG . . . . . 0.851 ' CG ' ' CD1' ' D' ' 18' ' ' LEU 0.357 85.3 mtt85 -55.51 -26.02 40.55 Favored 'General case' 0 N--CA 1.414 -2.236 0 C-N-CA 118.467 -1.293 . . . . 45.630000000000003 113.818 167.226 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' GLN . . . . . 0.473 ' O ' ' ND1' ' C' ' 47' ' ' HIS . 1.0 OUTLIER -94.28 30.11 2.02 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.427 -0.509 . . . . 28.890000000000001 111.88 171.081 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.82 -44.09 2.54 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 119.281 -0.968 . . . . 37.969999999999999 112.03 -174.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' MET . . . . . 0.493 ' O ' ' NE2' ' D' ' 14' ' ' GLN . 0.1 OUTLIER -97.49 -14.19 21.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 122.212 1.006 . . . . 59.579999999999998 109.354 176.02 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.09 68.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 113.849 -1.523 . . . . 65.069999999999993 108.726 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' HIS . . . . . 0.473 ' ND1' ' O ' ' C' ' 43' ' ' GLN . 57.9 m80 -56.13 -29.58 60.91 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 114.722 -1.126 . . . . 44.640000000000001 109.472 173.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' GLU . . . . . 0.498 ' OE1' ' O ' ' B' ' 58' ' ' GLY . 13.8 mt-10 -64.29 -14.7 57.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.019 0.748 . . . . 37.979999999999997 113.019 -175.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' ASN . . . . . 0.445 ' OD1' ' NE2' ' D' ' 14' ' ' GLN . 0.0 OUTLIER -112.06 27.28 9.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 123.175 1.464 . . . . 30.170000000000002 107.923 169.036 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.57 -46.54 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 113.632 -1.622 . . . . 60.259999999999998 109.16 176.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' C' ' 55' ' ' ILE . 40.9 m-85 -72.45 -47.62 47.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.643 -1.162 . . . . 25.859999999999999 111.597 171.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -51.05 -70.97 0.07 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.282 1.833 . . . . 52.950000000000003 111.372 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' GLY . . . . . . . . . . . . . . . -53.86 -35.84 54.1 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.628 -1.389 . . . . 59.939999999999998 109.628 175.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' MET . . . . . 0.459 ' O ' ' N ' ' C' ' 57' ' ' GLN . 0.0 OUTLIER -53.14 -69.8 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 118.161 -0.923 . . . . 41.579999999999998 109.214 174.429 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ILE . . . . . 0.449 ' N ' ' O ' ' C' ' 51' ' ' PHE . 0.1 OUTLIER -48.63 -38.63 9.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 O-C-N 125.702 1.876 . . . . 28.899999999999999 109.525 -177.512 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -50.67 -49.97 55.85 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 119.324 -0.951 . . . . 19.879999999999999 108.825 174.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLN . . . . . 0.459 ' N ' ' O ' ' C' ' 54' ' ' MET . 79.3 mt-30 -77.09 2.82 14.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.222 -0.899 . . . . 22.289999999999999 112.867 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.01 7.84 31.24 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 108.55 -1.82 . . . . 37.979999999999997 108.55 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' SER . . . . . . . . . . . . . 49.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.778 0.323 . . . . 33.920000000000002 111.184 -176.091 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t . . . . . 0 C--O 1.234 0.28 0 N-CA-C 111.56 0.207 . . . . 67.060000000000002 111.56 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -39.95 -71.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 125.637 1.575 . . . . 47.170000000000002 113.202 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLN . . . . . 0.493 ' NE2' ' O ' ' C' ' 45' ' ' MET . 87.3 mt-30 -44.09 -61.25 1.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 125.366 1.666 . . . . 59.359999999999999 110.338 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -42.53 -61.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.826 1.329 . . . . 47.25 110.292 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -46.6 -39.61 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 124.146 0.903 . . . . 59.359999999999999 109.561 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.83 -50.34 72.68 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 115.271 -0.877 . . . . 88.659999999999997 110.088 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' LEU . . . . . 0.851 ' CD1' ' CG ' ' C' ' 42' ' ' ARG . 74.3 mt -52.65 -39.07 61.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 125.101 1.501 . . . . 38.270000000000003 112.578 -177.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -57.99 -50.0 74.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 118.15 -1.42 . . . . 51.119999999999997 109.012 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -43.74 -65.7 0.47 Allowed 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.181 1.55 . . . . 52.329999999999998 110.166 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -51.84 -32.5 32.07 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.274 0.559 . . . . 65.900000000000006 110.411 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ARG . . . . . 0.711 ' NH1' ' CD1' ' C' ' 38' ' ' ILE . 79.5 mtp85 -61.37 -27.29 68.41 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 119.844 -0.742 . . . . 54.859999999999999 110.822 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -85.45 -50.47 7.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 119.212 -0.423 . . . . 69.450000000000003 111.329 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -52.99 -57.55 9.97 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 122.069 0.938 . . . . 47.950000000000003 108.889 176.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' VAL . . . . . 0.455 ' CG1' ' O ' ' C' ' 34' ' ' GLU . 19.5 t -43.6 -35.61 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 112.719 -2.037 . . . . 52.950000000000003 112.668 178.072 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.57 -4.34 30.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.613 0.72 . . . . 54.549999999999997 111.703 -176.825 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -124.45 0.34 8.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.701 -0.681 . . . . 63.890000000000001 110.246 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ILE . . . . . 1.565 ' CG2' ' CG ' ' D' ' 33' ' ' LEU . 96.9 mt -64.57 126.84 24.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-O 121.368 0.604 . . . . 49.130000000000003 111.241 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' SER . . . . . . . . . . . . . 4.8 p -68.15 169.75 9.75 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.748 -1.115 . . . . 33.640000000000001 108.585 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ARG . . . . . 0.686 ' NH2' ' O ' ' D' ' 64' ' ' HOH . 12.3 mtt180 -62.1 -58.23 8.59 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 116.053 -2.259 . . . . 46.909999999999997 111.807 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.82 -37.22 86.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.536 -1.265 . . . . 66.25 111.292 -176.856 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -57.33 -28.05 62.77 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 119.524 -0.87 . . . . 88.799999999999997 110.486 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' LEU . . . . . 1.565 ' CG ' ' CG2' ' D' ' 28' ' ' ILE . 55.0 mt -89.85 -52.28 5.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.465 1.126 . . . . 70.340000000000003 109.62 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' GLU . . . . . 0.506 ' OE2' ' O ' ' C' ' 25' ' ' VAL . 16.3 mt-10 -51.23 -22.29 2.59 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.176 -1.577 . . . . 76.859999999999999 113.466 177.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.02 -39.4 16.88 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.893 0.854 . . . . 56.140000000000001 111.112 172.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 mt -59.48 -47.78 84.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 118.107 -1.437 . . . . 38.490000000000002 109.071 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -52.66 -55.59 21.46 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 124.082 0.864 . . . . 57.670000000000002 112.067 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' ILE . . . . . . . . . . . . . 26.1 pt -52.68 -56.69 6.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 O-C-N 125.662 1.851 . . . . 46.329999999999998 108.399 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -47.4 -39.71 16.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 124.652 1.22 . . . . 63.909999999999997 109.879 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' VAL . . . . . . . . . . . . . 66.2 t -78.5 -16.05 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 114.546 -1.206 . . . . 60.189999999999998 112.502 -173.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -89.48 -26.58 5.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 117.316 -1.754 . . . . 78.579999999999998 109.133 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -3.84 4.32 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 115.516 -0.765 . . . . 104.36 111.111 -178.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' GLN . . . . . 0.752 ' C ' ' N ' ' D' ' 45' ' ' MET . 38.1 mt-30 -111.64 -47.76 3.13 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 113.69 -1.596 . . . . 82.400000000000006 114.645 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' LYS . . . . . 0.763 ' NZ ' ' CG2' ' C' ' 40' ' ' VAL . 42.5 mtmt -54.01 -4.88 0.06 Allowed 'General case' 0 C--O 1.165 -3.345 0 N-CA-C 100.568 -3.864 . . . . 90.349999999999994 100.568 -176.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' MET . . . . . 0.752 ' N ' ' C ' ' D' ' 43' ' ' GLN . 78.0 mmm -107.93 -42.78 4.6 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 127.824 2.45 . . . . 67.620000000000005 115.455 -177.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' D' ' 49' ' ' ASN . . . -56.85 -58.6 7.44 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.948 -1.095 . . . . 63.869999999999997 109.536 164.563 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' HIS . . . . . . . . . . . . . 29.9 m80 -47.55 -38.21 13.8 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.368 1.042 . . . . 39.829999999999998 110.745 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.75 -39.56 94.57 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.249 0.968 . . . . 55.479999999999997 110.951 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' ASN . . . . . 0.406 ' N ' ' O ' ' D' ' 46' ' ' ALA . 18.2 m-20 -61.66 -53.81 51.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.242 1.017 . . . . 52.57 112.657 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' ILE . . . . . 0.404 ' O ' ' N ' ' D' ' 54' ' ' MET . 4.8 mp -64.83 -25.99 39.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.624 -1.171 . . . . 45.0 111.588 178.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -89.6 -5.57 57.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.892 0.853 . . . . 51.280000000000001 109.181 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -83.83 -53.66 5.44 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 113.364 -1.744 . . . . 30.420000000000002 106.701 166.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' GLY . . . . . . . . . . . . . . . -59.87 -23.95 59.68 Favored Glycine 0 C--O 1.247 0.959 0 CA-C-N 114.189 -1.369 . . . . 54.079999999999998 110.969 172.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' MET . . . . . 0.404 ' N ' ' O ' ' D' ' 50' ' ' ILE . 0.0 OUTLIER -73.63 -40.84 63.48 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.644 0.378 . . . . 149.53999999999999 111.129 177.607 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -26.29 20.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 120.201 -0.6 . . . . 54.539999999999999 110.757 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -60.56 -17.43 46.14 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.778 1.231 . . . . 55.57 112.201 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -83.02 60.07 5.27 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 108.298 -1.001 . . . . 34.640000000000001 108.298 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' GLY . . . . . . . . . . . . . . . -115.99 24.32 10.16 Favored Glycine 0 CA--C 1.531 1.075 0 O-C-N 125.203 1.564 . . . . 46.619999999999997 109.202 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 50.520000000000003 111.245 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' HOH . . . . . 0.466 ' O ' ' NE2' ' B' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' HOH . . . . . 0.423 ' O ' ' NH1' ' D' ' 22' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' HOH . . . . . 0.686 ' O ' ' NH2' ' D' ' 30' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.481 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 54.9 t . . . . . 0 C--O 1.239 0.539 0 CA-C-O 117.339 -1.315 . . . . 24.129999999999999 109.572 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HA ' ' CD1' ' A' ' 16' ' ' PHE . 2.7 mt-10 -34.4 -67.16 0.14 Allowed 'General case' 0 C--N 1.321 -0.664 0 O-C-N 127.461 2.975 . . . . 28.059999999999999 112.16 -175.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HA ' ' HB2' ' A' ' 17' ' ' ASP . 6.4 mt-30 -43.82 -36.13 2.2 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 125.09 1.494 . . . . 27.629999999999999 111.31 175.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . 0.648 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 26.2 mt-30 -61.7 -32.96 73.19 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 121.135 -0.978 . . . . 16.890000000000001 109.446 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . 0.571 ' CD1' ' HA ' ' A' ' 13' ' ' GLU . 6.0 m-85 -62.17 -56.72 15.95 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.577 -1.638 . . . . 29.800000000000001 106.577 170.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . 0.687 ' HB2' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -35.42 -60.95 0.47 Allowed 'General case' 0 C--N 1.322 -0.614 0 O-C-N 126.909 2.63 . . . . 60.43 109.176 177.059 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 mt -45.72 -60.52 2.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 124.62 2.152 . . . . 22.75 113.563 175.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 34.7 mt-30 -57.55 -41.47 81.04 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 113.584 -1.644 . . . . 33.899999999999999 109.144 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -59.93 -45.0 94.0 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 126.363 2.289 . . . . 30.66 110.469 176.687 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 97.7 m-85 -69.88 -7.94 44.43 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.029 -1.67 . . . . 28.68 111.214 -179.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . 0.578 ' HG3' ' HA ' ' A' ' 19' ' ' GLN . 16.0 mtt85 -77.37 -54.16 6.8 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.074 -1.016 . . . . 19.239999999999998 111.192 -178.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLN . . . . . 0.488 ' O ' ' OD2' ' A' ' 27' ' ' ASP . 4.4 mt-30 -45.21 -52.62 9.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.767 1.27 . . . . 16.879999999999999 112.398 179.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLN . . . . . 0.77 ' OE1' ' HA ' ' A' ' 21' ' ' TYR . 37.7 mt-30 -52.02 -27.85 15.02 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 112.709 -2.042 . . . . 37.439999999999998 111.821 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . 0.788 ' HA ' HG12 ' A' ' 28' ' ' ILE . 44.0 t -109.5 -11.88 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 128.134 2.574 . . . . 10.74 114.346 -166.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -99.99 15.71 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 123.425 0.69 . . . . 28.32 109.694 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . 0.488 ' OD2' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -127.36 -29.31 2.72 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 126.935 2.094 . . . . 17.48 108.846 169.632 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . 0.788 HG12 ' HA ' ' A' ' 25' ' ' VAL . 26.8 pt -60.34 141.14 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 119.345 -0.942 . . . . 52.490000000000002 109.156 -177.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 77.8 p -76.33 173.97 10.78 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 126.288 2.242 . . . . 27.460000000000001 113.837 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.718 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -45.6 -81.48 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 127.223 2.209 . . . . 46.810000000000002 113.617 -178.489 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . 0.657 ' HA ' ' OE1' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -60.06 -42.53 94.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 118.376 -1.33 . . . . 34.229999999999997 108.454 -176.634 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.78 -8.19 20.06 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.064 0.852 . . . . 46.670000000000002 112.742 -178.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . 0.685 ' HB2' HG13 ' A' ' 28' ' ' ILE . 10.2 tp -106.43 11.3 30.96 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.378 -0.826 . . . . 62.969999999999999 108.782 170.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . 0.718 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 32.7 mt-10 -105.05 -37.73 6.84 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 113.14 0.793 . . . . 25.75 113.14 179.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . 0.714 ' HA ' ' CD1' ' A' ' 38' ' ' ILE . 3.9 m-20 -74.44 -12.49 60.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.675 1.226 . . . . 41.93 111.807 -175.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 mt -100.17 20.21 15.02 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 115.767 -2.373 . . . . 24.23 107.459 173.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . 0.673 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 t80 -119.34 -12.95 9.32 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 117.445 -1.702 . . . . 32.210000000000001 108.676 170.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.714 ' CD1' ' HA ' ' A' ' 35' ' ' ASP . 1.4 pt -89.77 -35.38 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.879 -1.055 . . . . 46.509999999999998 110.635 176.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 66.0 mt-10 -73.38 -18.63 61.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 123.506 1.622 . . . . 43.509999999999998 111.471 176.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . 0.702 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 4.0 t -84.01 -53.24 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 113.636 -1.62 . . . . 63.450000000000003 115.028 -175.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.732 ' HA ' ' HD2' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -68.27 -10.52 12.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 114.402 -1.272 . . . . 34.560000000000002 110.456 174.578 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . 1.195 ' CZ ' HH21 ' B' ' 22' ' ' ARG . 37.4 mtt85 -74.85 -50.2 17.89 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 124.008 0.818 . . . . 40.579999999999998 111.135 151.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -44.48 -80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 27.57 111.189 -179.519 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . 0.868 ' HG2' ' HD2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -31.31 -45.22 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.363 2.265 . . . . 34.090000000000003 113.133 178.909 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' MET . . . . . 0.597 ' HA ' ' HG3' ' A' ' 48' ' ' GLU . 16.0 mmm -68.39 -37.73 80.66 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.044 -0.41 . . . . 27.420000000000002 111.885 -175.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 50' ' ' ILE . . . -53.29 -30.7 40.16 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.192 1.397 . . . . 18.329999999999998 111.132 173.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . 0.759 ' HA ' ' HB ' ' A' ' 50' ' ' ILE . 12.1 m80 -80.52 -34.83 35.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.193 -1.367 . . . . 25.09 109.054 172.054 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HG3' ' HA ' ' A' ' 45' ' ' MET . 5.9 mt-10 -51.89 -49.22 63.45 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 124.242 0.964 . . . . 39.670000000000002 110.194 -177.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -67.47 -9.67 44.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.875 2.87 . . . . 26.390000000000001 112.366 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . 0.759 ' HB ' ' HA ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -101.5 -48.42 11.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.712 -1.585 . . . . 61.329999999999998 109.736 -172.801 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ILE . 39.8 t80 -60.72 -53.91 51.65 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 117.868 -1.533 . . . . 35.829999999999998 108.782 169.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . 0.77 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 22.4 mttt -43.12 -58.28 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 125.432 1.707 . . . . 35.950000000000003 109.103 171.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -48.41 -42.23 25.78 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 114.438 -1.255 . . . . 56.299999999999997 110.158 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' MET . . . . . 0.668 ' HG3' ' HB3' ' B' ' 54' ' ' MET . 0.0 OUTLIER -72.56 -30.85 64.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.761 0.824 . . . . 38.090000000000003 112.159 -178.238 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . 0.526 ' N ' ' O ' ' A' ' 51' ' ' PHE . 0.0 OUTLIER -89.99 -18.15 7.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 118.03 -1.468 . . . . 30.559999999999999 110.184 -179.359 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . 0.77 ' HG3' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -108.33 70.52 0.76 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 116.02 -2.272 . . . . 12.06 108.968 171.826 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -19.73 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 128.041 2.536 . . . . 28.149999999999999 108.932 -163.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.42 -31.8 6.63 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 109.524 -3.489 . . . . 27.350000000000001 111.802 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-O 120.788 0.328 . . . . 29.0 111.213 -179.835 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-O 121.131 0.491 . . . . 8.4000000000000004 109.862 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . 0.597 ' HA ' ' HD1' ' B' ' 16' ' ' PHE . 25.6 tt0 -50.97 -38.04 48.41 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.954 1.302 . . . . 39.57 112.427 -175.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 18' ' ' LEU . 11.4 mt-30 -61.04 -55.43 32.83 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 125.369 1.668 . . . . 24.52 109.103 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -45.69 -48.82 15.03 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 126.651 2.47 . . . . 20.190000000000001 108.865 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' PHE . . . . . 0.597 ' HD1' ' HA ' ' B' ' 13' ' ' GLU . 54.6 m-85 -50.78 -51.31 51.78 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.486 2.991 . . . . 27.699999999999999 109.985 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . 0.829 ' HA ' ' HD2' ' B' ' 20' ' ' LYS . 0.1 OUTLIER -56.8 -63.35 1.23 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.551 1.14 . . . . 31.219999999999999 111.302 -179.042 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . 1.046 HD13 ' HG2' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -45.39 -38.81 6.29 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 124.394 1.059 . . . . 33.689999999999998 111.569 -175.351 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLN . . . . . 0.922 ' HA ' ' HD2' ' B' ' 22' ' ' ARG . 36.8 mt-30 -64.94 -37.11 86.55 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 128.029 2.532 . . . . 36.770000000000003 112.338 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . 0.829 ' HD2' ' HA ' ' B' ' 17' ' ' ASP . 0.0 OUTLIER -75.34 -17.8 60.15 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 122.591 1.186 . . . . 44.460000000000001 110.567 177.689 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 21' ' ' TYR . . . . . 0.576 ' CD2' HG11 ' A' ' 41' ' ' VAL . 1.5 m-85 -89.9 -25.96 20.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.11 -0.95 . . . . 40.82 111.224 -179.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . 1.195 HH21 ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -91.97 -22.65 19.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 50.060000000000002 111.186 167.191 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLN . . . . . 0.692 ' HB2' ' HA ' ' B' ' 20' ' ' LYS . 0.5 OUTLIER -55.37 -47.47 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 31.920000000000002 111.179 157.748 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLN . . . . . 0.603 ' O ' ' N ' ' B' ' 26' ' ' ARG . 52.8 mt-30 -70.6 -86.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 30.210000000000001 111.223 166.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' VAL . . . . . 0.819 ' HA ' HG13 ' B' ' 28' ' ' ILE . 1.3 t -19.49 -58.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.462 . . . . 35.630000000000003 111.207 -159.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' B' ' 24' ' ' GLN . 3.9 mtt85 -25.8 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 48.979999999999997 111.208 177.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . 0.624 ' N ' ' O ' ' B' ' 25' ' ' VAL . 2.9 m-20 -89.83 -6.43 55.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 18.359999999999999 111.166 -169.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ILE . . . . . 0.924 HG22 ' H ' ' B' ' 29' ' ' SER . 1.5 mt -87.55 -163.72 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 36.939999999999998 111.222 -170.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' SER . . . . . 0.924 ' H ' HG22 ' B' ' 28' ' ' ILE . 1.3 p -146.06 147.46 31.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 30.199999999999999 111.236 -156.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -37.94 -44.8 0.81 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 114.079 1.14 . . . . 42.119999999999997 114.079 -171.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLU . . . . . 0.803 ' HA ' ' HB2' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -92.9 -28.29 16.57 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.24 0.459 . . . . 42.850000000000001 112.24 -176.99 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . 0.71 ' O ' ' HG ' ' B' ' 36' ' ' LEU . 1.3 m-20 -74.34 -20.34 60.13 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 118.675 -1.21 . . . . 65.209999999999994 110.854 -179.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . 0.916 HD21 HD12 ' B' ' 28' ' ' ILE . 9.0 mt -92.46 -29.77 16.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.018 -0.991 . . . . 49.590000000000003 109.219 168.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . 0.803 ' HB2' ' HA ' ' B' ' 31' ' ' GLU . 0.1 OUTLIER -51.79 -64.07 0.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 127.26 2.85 . . . . 30.969999999999999 107.541 173.8 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASP . . . . . 0.762 ' HA ' HG12 ' B' ' 38' ' ' ILE . 13.6 m-20 -59.16 -43.87 92.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 125.601 1.813 . . . . 43.950000000000003 112.315 178.494 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' B' ' 32' ' ' ASP . 0.7 OUTLIER -63.93 -26.9 68.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.439 -0.905 . . . . 48.869999999999997 108.789 178.881 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PHE . . . . . 1.056 ' HA ' HG13 ' B' ' 40' ' ' VAL . 86.2 t80 -82.0 -49.02 10.73 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 122.912 1.339 . . . . 61.259999999999998 111.365 175.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . 0.762 HG12 ' HA ' ' B' ' 35' ' ' ASP . 6.2 pt -57.7 -35.58 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 119.193 -2.192 . . . . 28.789999999999999 108.744 175.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' B' ' 35' ' ' ASP . 97.8 mt-10 -68.83 -30.67 69.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 113.568 -1.651 . . . . 24.98 107.71 179.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' VAL . . . . . 1.056 HG13 ' HA ' ' B' ' 37' ' ' PHE . 3.3 m -45.68 -69.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 125.855 1.972 . . . . 33.549999999999997 110.419 176.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . 0.968 ' N ' HG23 ' B' ' 40' ' ' VAL . 4.0 t -70.79 -15.18 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.69 0 O-C-N 126.369 2.293 . . . . 42.130000000000003 109.942 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ARG . . . . . 0.457 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 0.0 OUTLIER -75.61 -9.41 58.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.178 -0.919 . . . . 43.710000000000001 109.902 174.318 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . 0.418 ' O ' ' HB3' ' B' ' 46' ' ' ALA . 5.9 tt0 -112.26 -49.79 2.94 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.316 0.858 . . . . 50.82 113.316 177.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . 0.868 ' HD2' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -67.17 -7.48 23.94 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 113.327 0.862 . . . . 26.57 113.327 -173.049 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 95.1 mmm -79.65 -37.92 34.91 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.888 -1.153 . . . . 31.52 107.888 171.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 43' ' ' GLN . . . -67.68 -28.31 67.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 113.812 -1.54 . . . . 30.579999999999998 108.915 167.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' HIS . . . . . 0.717 ' HB2' ' HA ' ' B' ' 44' ' ' LYS . 41.7 m170 -82.57 0.8 41.11 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.714 1.259 . . . . 22.010000000000002 109.431 -179.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLU . . . . . 0.757 ' HG3' ' O ' ' B' ' 44' ' ' LYS . 11.5 mt-10 -108.89 -40.15 5.11 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.811 1.944 . . . . 65.319999999999993 110.711 169.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' B' ' 52' ' ' LYS . 6.5 m120 -68.66 -43.8 75.44 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 118.018 -1.473 . . . . 19.48 109.286 178.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -3.73 4.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 C-N-CA 124.557 1.143 . . . . 73.459999999999994 110.404 177.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 55' ' ' ILE . 43.4 t80 -113.25 -3.24 13.89 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.109 1.363 . . . . 40.689999999999998 110.483 172.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' B' ' 48' ' ' GLU . 10.7 mttt -102.47 -18.85 15.15 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 124.978 1.311 . . . . 32.090000000000003 108.938 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . 0.75 ' HA2' ' HD2' ' B' ' 56' ' ' ARG . . . -84.52 -47.5 5.38 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 108.678 -1.769 . . . . 26.420000000000002 108.678 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' MET . . . . . 0.668 ' HB3' ' HG3' ' A' ' 54' ' ' MET . 30.8 mmm -58.59 -22.73 56.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.944 -0.628 . . . . 33.509999999999998 111.991 177.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . 0.492 HG23 ' O ' ' B' ' 51' ' ' PHE . 0.3 OUTLIER -96.24 -12.44 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 114.139 -3.024 . . . . 27.66 107.436 174.325 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ARG . . . . . 0.75 ' HD2' ' HA2' ' B' ' 53' ' ' GLY . 0.0 OUTLIER -54.17 -26.49 28.23 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.155 -0.93 . . . . 58.850000000000001 111.347 176.388 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.39 26.87 0.36 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.799 1.182 . . . . 26.829999999999998 113.322 -176.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . 0.498 ' O ' ' OE1' ' C' ' 48' ' ' GLU . . . -82.5 54.0 4.86 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.324 -1.111 . . . . 30.899999999999999 110.324 175.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . 0.524 ' HA ' ' SD ' ' C' ' 45' ' ' MET . 99.0 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.817 0.341 . . . . 40.960000000000001 111.221 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' VAL . . . . . 0.477 ' N ' ' OE1' ' C' ' 15' ' ' GLN . 1.2 t . . . . . 0 CA--C 1.519 -0.238 0 N-CA-C 110.281 -0.266 . . . . 47.659999999999997 110.281 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -84.95 14.85 4.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.354 -0.384 . . . . 61.399999999999999 111.169 166.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLN . . . . . 0.616 ' O ' ' N ' ' C' ' 17' ' ' ASP . 0.0 OUTLIER -105.82 -54.49 2.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 38.609999999999999 111.182 143.912 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLN . . . . . 0.477 ' OE1' ' N ' ' C' ' 12' ' ' VAL . 4.5 mt-30 -53.7 -30.53 44.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.298 1.047 . . . . 46.880000000000003 111.778 -175.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' PHE . . . . . 0.77 ' O ' ' HG3' ' C' ' 20' ' ' LYS . 4.9 m-30 -67.64 -24.51 65.46 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.326 -1.361 . . . . 26.309999999999999 107.326 175.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ASP . . . . . 0.758 ' O ' ' HB2' ' C' ' 20' ' ' LYS . 57.1 m-20 -81.79 -45.77 15.14 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 117.859 -1.067 . . . . 38.520000000000003 111.134 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 18' ' ' LEU . . . . . 0.827 HD21 ' HG2' ' D' ' 42' ' ' ARG . 6.6 mt -51.72 -58.42 6.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 118.747 0.703 . . . . 37.380000000000003 110.85 -178.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' GLN . . . . . 0.415 ' HA ' ' CD ' ' C' ' 22' ' ' ARG . 75.3 mt-30 -48.09 -40.87 24.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.845 0.831 . . . . 34.119999999999997 110.637 -178.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' LYS . . . . . 0.77 ' HG3' ' O ' ' C' ' 16' ' ' PHE . 13.4 mttt -46.29 -67.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 113.075 -1.875 . . . . 35.979999999999997 110.934 179.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' TYR . . . . . 0.879 ' HA ' ' HG3' ' C' ' 24' ' ' GLN . 0.0 OUTLIER -59.16 -34.39 72.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.513 2.325 . . . . 48.109999999999999 111.152 -176.391 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ARG . . . . . 0.752 ' O ' ' HB2' ' C' ' 26' ' ' ARG . 2.4 mtp180 -67.37 -6.44 18.95 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.053 -0.522 . . . . 27.800000000000001 111.701 -175.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -74.79 -54.45 7.31 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.467 2.307 . . . . 23.100000000000001 109.89 157.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' GLN . . . . . 0.879 ' HG3' ' HA ' ' C' ' 21' ' ' TYR . 8.1 mt-30 -51.67 -70.58 0.08 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.355 -1.293 . . . . 30.84 111.038 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 25' ' ' VAL . . . . . 1.203 ' CG1' HD21 ' C' ' 33' ' ' LEU . 0.0 OUTLIER -44.29 -58.64 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 125.606 1.816 . . . . 37.850000000000001 109.496 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' C' ' 22' ' ' ARG . 0.5 OUTLIER -43.06 -31.83 0.6 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 113.714 -1.584 . . . . 76.060000000000002 113.065 176.206 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -103.48 -17.28 15.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.181 1.393 . . . . 25.98 114.186 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ILE . . . . . 1.4 ' CG2' ' HG ' ' C' ' 33' ' ' LEU . 13.7 tt -73.66 169.93 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-O 122.651 1.215 . . . . 44.670000000000002 112.305 -177.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 29' ' ' SER . . . . . 0.623 ' OG ' ' HB2' ' C' ' 32' ' ' ASP . 0.9 OUTLIER -86.11 -177.2 6.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.176 1.917 . . . . 38.240000000000002 116.176 -167.286 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ARG . . . . . 0.617 ' O ' ' HG3' ' C' ' 34' ' ' GLU . 0.7 OUTLIER -71.85 -28.23 63.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 112.324 -2.217 . . . . 44.829999999999998 110.603 176.306 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 31' ' ' GLU . . . . . 0.713 ' O ' ' HB2' ' C' ' 34' ' ' GLU . 0.0 OUTLIER -103.15 -33.59 9.15 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.372 -0.831 . . . . 16.32 112.352 -179.832 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ASP . . . . . 0.683 ' O ' HD11 ' C' ' 28' ' ' ILE . 11.2 m-20 -78.56 -26.15 45.53 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 130.649 3.579 . . . . 17.510000000000002 113.344 -171.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 33' ' ' LEU . . . . . 1.4 ' HG ' ' CG2' ' C' ' 28' ' ' ILE . 6.8 mt -84.43 -16.09 43.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 117.196 -1.802 . . . . 45.170000000000002 107.59 169.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 34' ' ' GLU . . . . . 0.713 ' HB2' ' O ' ' C' ' 31' ' ' GLU . 13.4 mt-10 -72.58 -53.73 11.11 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 114.592 -1.185 . . . . 68.730000000000004 112.704 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ASP . . . . . 0.475 ' O ' HG12 ' C' ' 38' ' ' ILE . 3.1 m-20 -81.65 15.51 2.11 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 118.92 -2.362 . . . . 53.890000000000001 111.179 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' LEU . . . . . 0.624 ' O ' ' HB2' ' C' ' 39' ' ' GLU . 3.2 mt -94.44 -41.46 9.37 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.896 1.279 . . . . 35.520000000000003 110.603 172.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 37' ' ' PHE . . . . . 1.101 ' CE2' HD22 ' D' ' 33' ' ' LEU . 18.7 m-30 -58.7 -47.03 85.93 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 117.659 -1.616 . . . . 53.700000000000003 109.267 172.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' ILE . . . . . 0.717 ' CD1' HH12 ' D' ' 22' ' ' ARG . 0.5 OUTLIER -49.72 -33.81 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 125.656 1.848 . . . . 30.600000000000001 111.498 174.6 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 39' ' ' GLU . . . . . 0.624 ' HB2' ' O ' ' C' ' 36' ' ' LEU . 5.3 mm-40 -65.06 -81.42 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 126.189 2.181 . . . . 48.850000000000001 110.061 176.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 40' ' ' VAL . . . . . 1.113 HG13 ' HD3' ' D' ' 44' ' ' LYS . 19.0 t -60.74 -13.58 7.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-N 115.747 -0.66 . . . . 41.039999999999999 112.505 -178.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 41' ' ' VAL . . . . . 0.812 ' HA ' ' HZ3' ' C' ' 44' ' ' LYS . 93.7 t -68.49 -37.7 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 112.569 -3.653 . . . . 64.959999999999994 107.401 173.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ARG . . . . . 1.247 ' HG2' ' CD1' ' D' ' 18' ' ' LEU 0.357 85.3 mtt85 -55.51 -26.02 40.55 Favored 'General case' 0 N--CA 1.414 -2.236 0 C-N-CA 118.467 -1.293 . . . . 45.630000000000003 113.818 167.226 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 43' ' ' GLN . . . . . 0.473 ' O ' ' ND1' ' C' ' 47' ' ' HIS . 1.0 OUTLIER -94.28 30.11 2.02 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.427 -0.509 . . . . 28.890000000000001 111.88 171.081 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LYS . . . . . 0.812 ' HZ3' ' HA ' ' C' ' 41' ' ' VAL . 0.0 OUTLIER -119.82 -44.09 2.54 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 119.281 -0.968 . . . . 37.969999999999999 112.03 -174.223 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 45' ' ' MET . . . . . 0.612 ' HE2' ' HG2' ' D' ' 14' ' ' GLN . 0.1 OUTLIER -97.49 -14.19 21.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 122.212 1.006 . . . . 59.579999999999998 109.354 176.02 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.09 68.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 113.849 -1.523 . . . . 65.069999999999993 108.726 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' HIS . . . . . 0.677 ' O ' ' HB ' ' C' ' 50' ' ' ILE . 57.9 m80 -56.13 -29.58 60.91 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 114.722 -1.126 . . . . 44.640000000000001 109.472 173.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 48' ' ' GLU . . . . . 0.556 ' HB2' ' O ' ' C' ' 45' ' ' MET . 13.8 mt-10 -64.29 -14.7 57.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.019 0.748 . . . . 37.979999999999997 113.019 -175.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 49' ' ' ASN . . . . . 0.424 ' ND2' ' OE1' ' D' ' 14' ' ' GLN . 0.0 OUTLIER -112.06 27.28 9.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 123.175 1.464 . . . . 30.170000000000002 107.923 169.036 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 50' ' ' ILE . . . . . 0.677 ' HB ' ' O ' ' C' ' 47' ' ' HIS . 0.1 OUTLIER -100.57 -46.54 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 113.632 -1.622 . . . . 60.259999999999998 109.16 176.575 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 51' ' ' PHE . . . . . 0.612 ' HE1' ' HB ' ' D' ' 50' ' ' ILE . 40.9 m-85 -72.45 -47.62 47.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.643 -1.162 . . . . 25.859999999999999 111.597 171.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 52' ' ' LYS . . . . . 0.776 ' O ' ' HG3' ' C' ' 56' ' ' ARG . 1.7 ttmt -51.05 -70.97 0.07 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.282 1.833 . . . . 52.950000000000003 111.372 -179.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 53' ' ' GLY . . . . . 0.661 ' HA2' ' HD2' ' C' ' 56' ' ' ARG . . . -53.86 -35.84 54.1 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.628 -1.389 . . . . 59.939999999999998 109.628 175.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 54' ' ' MET . . . . . 0.686 ' HG3' ' HG3' ' D' ' 54' ' ' MET . 0.0 OUTLIER -53.14 -69.8 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 118.161 -0.923 . . . . 41.579999999999998 109.214 174.429 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ILE . . . . . 0.738 HG12 ' O ' ' C' ' 52' ' ' LYS . 0.1 OUTLIER -48.63 -38.63 9.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 O-C-N 125.702 1.876 . . . . 28.899999999999999 109.525 -177.512 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 56' ' ' ARG . . . . . 0.776 ' HG3' ' O ' ' C' ' 52' ' ' LYS . 51.3 mtt180 -50.67 -49.97 55.85 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 119.324 -0.951 . . . . 19.879999999999999 108.825 174.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLN . . . . . 0.459 ' N ' ' O ' ' C' ' 54' ' ' MET . 79.3 mt-30 -77.09 2.82 14.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.222 -0.899 . . . . 22.289999999999999 112.867 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.01 7.84 31.24 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 108.55 -1.82 . . . . 37.979999999999997 108.55 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' SER . . . . . . . . . . . . . 49.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.778 0.323 . . . . 33.920000000000002 111.184 -176.091 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 12' ' ' VAL . . . . . 0.403 ' HB ' ' H ' ' D' ' 13' ' ' GLU . 2.2 t . . . . . 0 C--O 1.234 0.28 0 N-CA-C 111.56 0.207 . . . . 67.060000000000002 111.56 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' D' ' 16' ' ' PHE . 69.5 mt-10 -39.95 -71.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 125.637 1.575 . . . . 47.170000000000002 113.202 -177.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLN . . . . . 0.64 ' O ' ' HB2' ' D' ' 17' ' ' ASP . 27.1 mt-30 -44.09 -61.25 1.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 125.366 1.666 . . . . 59.359999999999999 110.338 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -42.53 -61.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.826 1.329 . . . . 47.25 110.292 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' D' ' 13' ' ' GLU . 5.3 m-85 -46.6 -39.61 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 124.146 0.903 . . . . 59.359999999999999 109.561 177.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ASP . . . . . 0.76 ' HA ' ' HE3' ' D' ' 20' ' ' LYS . 1.1 m-20 -61.83 -50.34 72.68 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 115.271 -0.877 . . . . 88.659999999999997 110.088 179.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' LEU . . . . . 1.247 ' CD1' ' HG2' ' C' ' 42' ' ' ARG . 74.3 mt -52.65 -39.07 61.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 125.101 1.501 . . . . 38.270000000000003 112.578 -177.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' GLN . . . . . 0.684 ' O ' ' HB2' ' D' ' 22' ' ' ARG . 35.7 mt-30 -57.99 -50.0 74.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 118.15 -1.42 . . . . 51.119999999999997 109.012 176.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 20' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' D' ' 17' ' ' ASP . 5.6 mttt -43.74 -65.7 0.47 Allowed 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.181 1.55 . . . . 52.329999999999998 110.166 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 21' ' ' TYR . . . . . 0.612 ' CD1' HG11 ' C' ' 41' ' ' VAL . 9.6 m-85 -51.84 -32.5 32.07 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.274 0.559 . . . . 65.900000000000006 110.411 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ARG . . . . . 0.821 ' HG3' ' O ' ' D' ' 18' ' ' LEU . 79.5 mtp85 -61.37 -27.29 68.41 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 119.844 -0.742 . . . . 54.859999999999999 110.822 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -85.45 -50.47 7.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 119.212 -0.423 . . . . 69.450000000000003 111.329 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -52.99 -57.55 9.97 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 122.069 0.938 . . . . 47.950000000000003 108.889 176.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' VAL . . . . . 0.696 HG11 ' O ' ' C' ' 34' ' ' GLU . 19.5 t -43.6 -35.61 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 112.719 -2.037 . . . . 52.950000000000003 112.668 178.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.57 -4.34 30.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.613 0.72 . . . . 54.549999999999997 111.703 -176.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -124.45 0.34 8.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.701 -0.681 . . . . 63.890000000000001 110.246 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ILE . . . . . 1.565 ' CG2' ' CG ' ' D' ' 33' ' ' LEU . 96.9 mt -64.57 126.84 24.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-O 121.368 0.604 . . . . 49.130000000000003 111.241 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' SER . . . . . 0.523 ' O ' HG22 ' D' ' 28' ' ' ILE . 4.8 p -68.15 169.75 9.75 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.748 -1.115 . . . . 33.640000000000001 108.585 178.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ARG . . . . . 0.686 ' NH2' ' O ' ' D' ' 64' ' ' HOH . 12.3 mtt180 -62.1 -58.23 8.59 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 116.053 -2.259 . . . . 46.909999999999997 111.807 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' GLU . . . . . 0.404 ' H ' ' HG2' ' D' ' 31' ' ' GLU . 0.6 OUTLIER -63.82 -37.22 86.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.536 -1.265 . . . . 66.25 111.292 -176.856 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -57.33 -28.05 62.77 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 119.524 -0.87 . . . . 88.799999999999997 110.486 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' LEU . . . . . 1.565 ' CG ' ' CG2' ' D' ' 28' ' ' ILE . 55.0 mt -89.85 -52.28 5.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.465 1.126 . . . . 70.340000000000003 109.62 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' GLU . . . . . 0.669 ' OE1' ' HA ' ' C' ' 26' ' ' ARG . 16.3 mt-10 -51.23 -22.29 2.59 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.176 -1.577 . . . . 76.859999999999999 113.466 177.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ASP . . . . . 0.75 ' O ' ' HG3' ' D' ' 39' ' ' GLU . 1.6 m-20 -86.02 -39.4 16.88 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.893 0.854 . . . . 56.140000000000001 111.112 172.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 36' ' ' LEU . . . . . 0.751 ' O ' HG23 ' D' ' 40' ' ' VAL . 44.9 mt -59.48 -47.78 84.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 118.107 -1.437 . . . . 38.490000000000002 109.071 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 37' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -52.66 -55.59 21.46 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 124.082 0.864 . . . . 57.670000000000002 112.067 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' ILE . . . . . 0.705 HG22 ' HG2' ' C' ' 22' ' ' ARG . 26.1 pt -52.68 -56.69 6.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 O-C-N 125.662 1.851 . . . . 46.329999999999998 108.399 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 39' ' ' GLU . . . . . 0.75 ' HG3' ' O ' ' D' ' 35' ' ' ASP . 52.6 mt-10 -47.4 -39.71 16.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 124.652 1.22 . . . . 63.909999999999997 109.879 178.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 40' ' ' VAL . . . . . 0.751 HG23 ' O ' ' D' ' 36' ' ' LEU . 66.2 t -78.5 -16.05 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 114.546 -1.206 . . . . 60.189999999999998 112.502 -173.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 41' ' ' VAL . . . . . 0.588 HG21 ' CD2' ' C' ' 21' ' ' TYR . 84.3 t -89.48 -26.58 5.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 117.316 -1.754 . . . . 78.579999999999998 109.133 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 42' ' ' ARG . . . . . 0.827 ' HG2' HD21 ' C' ' 18' ' ' LEU . 0.3 OUTLIER -65.17 -3.84 4.32 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 115.516 -0.765 . . . . 104.36 111.111 -178.921 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 43' ' ' GLN . . . . . 0.784 ' C ' ' H ' ' D' ' 45' ' ' MET . 24.4 mt-30 -111.64 -47.76 3.13 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 113.69 -1.596 . . . . 82.400000000000006 114.645 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 44' ' ' LYS . . . . . 1.113 ' HD3' HG13 ' C' ' 40' ' ' VAL . 42.5 mtmt -54.01 -4.88 0.06 Allowed 'General case' 0 C--O 1.165 -3.345 0 N-CA-C 100.568 -3.864 . . . . 90.349999999999994 100.568 -176.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' MET . . . . . 0.784 ' H ' ' C ' ' D' ' 43' ' ' GLN . 78.0 mmm -107.93 -42.78 4.6 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 127.824 2.45 . . . . 67.620000000000005 115.455 -177.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 46' ' ' ALA . . . . . 0.72 ' O ' HD12 ' D' ' 50' ' ' ILE . . . -56.85 -58.6 7.44 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.948 -1.095 . . . . 63.869999999999997 109.536 164.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 47' ' ' HIS . . . . . 0.512 ' HA ' ' HZ ' ' C' ' 51' ' ' PHE . 24.4 m-70 -47.55 -38.21 13.8 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.368 1.042 . . . . 39.829999999999998 110.745 177.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.75 -39.56 94.57 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.249 0.968 . . . . 55.479999999999997 110.951 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 49' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' D' ' 52' ' ' LYS . 18.2 m-20 -61.66 -53.81 51.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.242 1.017 . . . . 52.57 112.657 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 50' ' ' ILE . . . . . 0.72 HD12 ' O ' ' D' ' 46' ' ' ALA . 4.8 mp -64.83 -25.99 39.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.624 -1.171 . . . . 45.0 111.588 178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 51' ' ' PHE . . . . . 0.747 ' HA ' ' HB2' ' D' ' 54' ' ' MET . 51.5 t80 -89.6 -5.57 57.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.892 0.853 . . . . 51.280000000000001 109.181 175.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 52' ' ' LYS . . . . . 0.774 ' O ' ' HG3' ' D' ' 56' ' ' ARG . 30.2 mttt -83.83 -53.66 5.44 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 113.364 -1.744 . . . . 30.420000000000002 106.701 166.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 53' ' ' GLY . . . . . 0.622 ' HA2' ' HD2' ' D' ' 56' ' ' ARG . . . -59.87 -23.95 59.68 Favored Glycine 0 C--O 1.247 0.959 0 CA-C-N 114.189 -1.369 . . . . 54.079999999999998 110.969 172.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' MET . . . . . 0.747 ' HB2' ' HA ' ' D' ' 51' ' ' PHE . 0.0 OUTLIER -73.63 -40.84 63.48 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.644 0.378 . . . . 149.53999999999999 111.129 177.607 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 55' ' ' ILE . . . . . 0.532 HG12 ' O ' ' D' ' 51' ' ' PHE . 0.0 OUTLIER -74.4 -26.29 20.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 120.201 -0.6 . . . . 54.539999999999999 110.757 177.215 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 56' ' ' ARG . . . . . 0.774 ' HG3' ' O ' ' D' ' 52' ' ' LYS . 83.2 mtt180 -60.56 -17.43 46.14 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.778 1.231 . . . . 55.57 112.201 -176.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -83.02 60.07 5.27 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 108.298 -1.001 . . . . 34.640000000000001 108.298 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' GLY . . . . . . . . . . . . . . . -115.99 24.32 10.16 Favored Glycine 0 CA--C 1.531 1.075 0 O-C-N 125.203 1.564 . . . . 46.619999999999997 109.202 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 50.520000000000003 111.245 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 62' ' ' HOH . . . . . 0.466 ' O ' ' NE2' ' B' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 64' ' ' HOH . . . . . 0.686 ' O ' ' NH2' ' D' ' 30' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.481 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 54.9 t . . . . . 0 C--O 1.239 0.539 0 CA-C-O 117.339 -1.315 . . . . 24.129999999999999 109.572 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HA ' ' CD1' ' A' ' 16' ' ' PHE . 2.7 mt-10 -34.4 -67.16 0.14 Allowed 'General case' 0 C--N 1.321 -0.664 0 O-C-N 127.461 2.975 . . . . 28.059999999999999 112.16 -175.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HA ' ' HB2' ' A' ' 17' ' ' ASP . 21.0 mt-30 -43.82 -36.13 2.2 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 125.09 1.494 . . . . 27.629999999999999 111.31 175.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.648 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 26.2 mt-30 -61.7 -32.96 73.19 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 121.135 -0.978 . . . . 16.890000000000001 109.446 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.571 ' CD1' ' HA ' ' A' ' 13' ' ' GLU . 6.0 m-85 -62.17 -56.72 15.95 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.577 -1.638 . . . . 29.800000000000001 106.577 170.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.687 ' HB2' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -35.42 -60.95 0.47 Allowed 'General case' 0 C--N 1.322 -0.614 0 O-C-N 126.909 2.63 . . . . 60.43 109.176 177.059 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 mt -45.72 -60.52 2.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 124.62 2.152 . . . . 22.75 113.563 175.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 34.7 mt-30 -57.55 -41.47 81.04 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-N 113.584 -1.644 . . . . 33.899999999999999 109.144 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -59.93 -45.0 94.0 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 126.363 2.289 . . . . 30.66 110.469 176.687 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.77 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 97.7 m-85 -69.88 -7.94 44.43 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.029 -1.67 . . . . 28.68 111.214 -179.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.578 ' HG3' ' HA ' ' A' ' 19' ' ' GLN . 16.0 mtt85 -77.37 -54.16 6.8 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.074 -1.016 . . . . 19.239999999999998 111.192 -178.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.488 ' O ' ' OD2' ' A' ' 27' ' ' ASP . 4.4 mt-30 -45.21 -52.62 9.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.767 1.27 . . . . 16.879999999999999 112.398 179.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.77 ' OE1' ' HA ' ' A' ' 21' ' ' TYR . 37.7 mt-30 -52.02 -27.85 15.02 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 112.709 -2.042 . . . . 37.439999999999998 111.821 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.788 ' HA ' HG12 ' A' ' 28' ' ' ILE . 44.0 t -109.5 -11.88 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 128.134 2.574 . . . . 10.74 114.346 -166.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -99.99 15.71 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 123.425 0.69 . . . . 28.32 109.694 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.488 ' OD2' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -127.36 -29.31 2.72 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 126.935 2.094 . . . . 17.48 108.846 169.632 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.788 HG12 ' HA ' ' A' ' 25' ' ' VAL . 26.8 pt -60.34 141.14 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 119.345 -0.942 . . . . 52.490000000000002 109.156 -177.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 77.8 p -76.33 173.97 10.78 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 126.288 2.242 . . . . 27.460000000000001 113.837 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.718 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -45.6 -81.48 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 127.223 2.209 . . . . 46.810000000000002 113.617 -178.489 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.657 ' HA ' ' OE1' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -60.06 -42.53 94.71 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 118.376 -1.33 . . . . 34.229999999999997 108.454 -176.634 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.78 -8.19 20.06 Favored 'General case' 0 C--O 1.242 0.692 0 O-C-N 124.064 0.852 . . . . 46.670000000000002 112.742 -178.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.685 ' HB2' HG13 ' A' ' 28' ' ' ILE . 10.2 tp -106.43 11.3 30.96 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.378 -0.826 . . . . 62.969999999999999 108.782 170.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.718 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 32.7 mt-10 -105.05 -37.73 6.84 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 113.14 0.793 . . . . 25.75 113.14 179.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.714 ' HA ' ' CD1' ' A' ' 38' ' ' ILE . 3.9 m-20 -74.44 -12.49 60.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.675 1.226 . . . . 41.93 111.807 -175.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 mt -100.17 20.21 15.02 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 115.767 -2.373 . . . . 24.23 107.459 173.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.673 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 t80 -119.34 -12.95 9.32 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 117.445 -1.702 . . . . 32.210000000000001 108.676 170.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.714 ' CD1' ' HA ' ' A' ' 35' ' ' ASP . 1.4 pt -89.77 -35.38 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 114.879 -1.055 . . . . 46.509999999999998 110.635 176.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 66.0 mt-10 -73.38 -18.63 61.14 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 123.506 1.622 . . . . 43.509999999999998 111.471 176.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.702 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 4.0 t -84.01 -53.24 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 113.636 -1.62 . . . . 63.450000000000003 115.028 -175.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.732 ' HA ' ' HD2' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -68.27 -10.52 12.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 114.402 -1.272 . . . . 34.560000000000002 110.456 174.578 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . 1.195 ' CZ ' HH21 ' B' ' 22' ' ' ARG . 37.4 mtt85 -74.85 -50.2 17.89 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 124.008 0.818 . . . . 40.579999999999998 111.135 151.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -44.48 -80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 27.57 111.189 -179.519 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.868 ' HG2' ' HD2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -31.31 -45.22 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.363 2.265 . . . . 34.090000000000003 113.133 178.909 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' MET . . . . . 0.597 ' HA ' ' HG3' ' A' ' 48' ' ' GLU . 16.0 mmm -68.39 -37.73 80.66 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 122.044 -0.41 . . . . 27.420000000000002 111.885 -175.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 50' ' ' ILE . . . -53.29 -30.7 40.16 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.192 1.397 . . . . 18.329999999999998 111.132 173.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.759 ' HA ' ' HB ' ' A' ' 50' ' ' ILE . 12.1 m80 -80.52 -34.83 35.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.193 -1.367 . . . . 25.09 109.054 172.054 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HG3' ' HA ' ' A' ' 45' ' ' MET . 5.9 mt-10 -51.89 -49.22 63.45 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 124.242 0.964 . . . . 39.670000000000002 110.194 -177.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -67.47 -9.67 44.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.875 2.87 . . . . 26.390000000000001 112.366 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.759 ' HB ' ' HA ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -101.5 -48.42 11.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.712 -1.585 . . . . 61.329999999999998 109.736 -172.801 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ILE . 39.8 t80 -60.72 -53.91 51.65 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 117.868 -1.533 . . . . 35.829999999999998 108.782 169.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.77 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 22.4 mttt -43.12 -58.28 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 125.432 1.707 . . . . 35.950000000000003 109.103 171.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -48.41 -42.23 25.78 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 114.438 -1.255 . . . . 56.299999999999997 110.158 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' MET . . . . . 0.668 ' HG3' ' HB3' ' B' ' 54' ' ' MET . 0.0 OUTLIER -72.56 -30.85 64.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.761 0.824 . . . . 38.090000000000003 112.159 -178.238 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.526 ' N ' ' O ' ' A' ' 51' ' ' PHE . 0.0 OUTLIER -89.99 -18.15 7.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 118.03 -1.468 . . . . 30.559999999999999 110.184 -179.359 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.77 ' HG3' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -108.33 70.52 0.76 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 116.02 -2.272 . . . . 12.06 108.968 171.826 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -19.73 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 128.041 2.536 . . . . 28.149999999999999 108.932 -163.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -97.42 -31.8 6.63 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 109.524 -3.489 . . . . 27.350000000000001 111.802 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.6 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-O 120.788 0.328 . . . . 29.0 111.213 -179.835 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-O 121.131 0.491 . . . . 8.4000000000000004 109.862 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.597 ' HA ' ' HD1' ' B' ' 16' ' ' PHE . 25.6 tt0 -50.97 -38.04 48.41 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.954 1.302 . . . . 39.57 112.427 -175.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 18' ' ' LEU . 11.4 mt-30 -61.04 -55.43 32.83 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 125.369 1.668 . . . . 24.52 109.103 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -45.69 -48.82 15.03 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 126.651 2.47 . . . . 20.190000000000001 108.865 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' PHE . . . . . 0.597 ' HD1' ' HA ' ' B' ' 13' ' ' GLU . 54.6 m-85 -50.78 -51.31 51.78 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 127.486 2.991 . . . . 27.699999999999999 109.985 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.829 ' HA ' ' HD2' ' B' ' 20' ' ' LYS . 0.1 OUTLIER -56.8 -63.35 1.23 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.551 1.14 . . . . 31.219999999999999 111.302 -179.042 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . 1.046 HD13 ' HG2' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -45.39 -38.81 6.29 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 124.394 1.059 . . . . 33.689999999999998 111.569 -175.351 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.922 ' HA ' ' HD2' ' B' ' 22' ' ' ARG . 36.8 mt-30 -64.94 -37.11 86.55 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 128.029 2.532 . . . . 36.770000000000003 112.338 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.829 ' HD2' ' HA ' ' B' ' 17' ' ' ASP . 0.0 OUTLIER -75.34 -17.8 60.15 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 122.591 1.186 . . . . 44.460000000000001 110.567 177.689 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' TYR . . . . . 0.576 ' CD2' HG11 ' A' ' 41' ' ' VAL . 1.5 m-85 -89.9 -25.96 20.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.11 -0.95 . . . . 40.82 111.224 -179.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . 1.195 HH21 ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -91.97 -22.65 19.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 50.060000000000002 111.186 167.191 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLN . . . . . 0.692 ' HB2' ' HA ' ' B' ' 20' ' ' LYS . 0.5 OUTLIER -55.37 -47.47 75.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 31.920000000000002 111.179 157.748 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLN . . . . . 0.603 ' O ' ' N ' ' B' ' 26' ' ' ARG . 52.8 mt-30 -70.6 -86.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 30.210000000000001 111.223 166.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.819 ' HA ' HG13 ' B' ' 28' ' ' ILE . 1.3 t -19.49 -58.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.462 . . . . 35.630000000000003 111.207 -159.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.603 ' N ' ' O ' ' B' ' 24' ' ' GLN . 3.9 mtt85 -25.8 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 48.979999999999997 111.208 177.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.624 ' N ' ' O ' ' B' ' 25' ' ' VAL . 2.9 m-20 -89.83 -6.43 55.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 18.359999999999999 111.166 -169.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ILE . . . . . 0.924 HG22 ' H ' ' B' ' 29' ' ' SER . 1.5 mt -87.55 -163.72 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 36.939999999999998 111.222 -170.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' SER . . . . . 0.924 ' H ' HG22 ' B' ' 28' ' ' ILE . 1.3 p -146.06 147.46 31.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 30.199999999999999 111.236 -156.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -37.94 -44.8 0.81 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 114.079 1.14 . . . . 42.119999999999997 114.079 -171.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.803 ' HA ' ' HB2' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -92.9 -28.29 16.57 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.24 0.459 . . . . 42.850000000000001 112.24 -176.99 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.71 ' O ' ' HG ' ' B' ' 36' ' ' LEU . 1.3 m-20 -74.34 -20.34 60.13 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 118.675 -1.21 . . . . 65.209999999999994 110.854 -179.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.916 HD21 HD12 ' B' ' 28' ' ' ILE . 9.0 mt -92.46 -29.77 16.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 118.018 -0.991 . . . . 49.590000000000003 109.219 168.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.803 ' HB2' ' HA ' ' B' ' 31' ' ' GLU . 0.1 OUTLIER -51.79 -64.07 0.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 127.26 2.85 . . . . 30.969999999999999 107.541 173.8 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASP . . . . . 0.762 ' HA ' HG12 ' B' ' 38' ' ' ILE . 13.6 m-20 -59.16 -43.87 92.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 125.601 1.813 . . . . 43.950000000000003 112.315 178.494 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' B' ' 32' ' ' ASP . 0.7 OUTLIER -63.93 -26.9 68.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.439 -0.905 . . . . 48.869999999999997 108.789 178.881 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PHE . . . . . 1.056 ' HA ' HG13 ' B' ' 40' ' ' VAL . 86.2 t80 -82.0 -49.02 10.73 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 122.912 1.339 . . . . 61.259999999999998 111.365 175.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.762 HG12 ' HA ' ' B' ' 35' ' ' ASP . 6.2 pt -57.7 -35.58 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 O-C-N 119.193 -2.192 . . . . 28.789999999999999 108.744 175.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' B' ' 35' ' ' ASP . 97.8 mt-10 -68.83 -30.67 69.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 113.568 -1.651 . . . . 24.98 107.71 179.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' VAL . . . . . 1.056 HG13 ' HA ' ' B' ' 37' ' ' PHE . 3.3 m -45.68 -69.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.363 0 O-C-N 125.855 1.972 . . . . 33.549999999999997 110.419 176.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . 0.968 ' N ' HG23 ' B' ' 40' ' ' VAL . 4.0 t -70.79 -15.18 18.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.69 0 O-C-N 126.369 2.293 . . . . 42.130000000000003 109.942 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.457 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 0.0 OUTLIER -75.61 -9.41 58.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.178 -0.919 . . . . 43.710000000000001 109.902 174.318 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.418 ' O ' ' HB3' ' B' ' 46' ' ' ALA . 5.9 tt0 -112.26 -49.79 2.94 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.316 0.858 . . . . 50.82 113.316 177.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.868 ' HD2' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -67.17 -7.48 23.94 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 113.327 0.862 . . . . 26.57 113.327 -173.049 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' MET . . . . . 0.449 ' O ' ' ND2' ' B' ' 49' ' ' ASN . 95.1 mmm -79.65 -37.92 34.91 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.888 -1.153 . . . . 31.52 107.888 171.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.505 ' HA ' HD22 ' B' ' 49' ' ' ASN . . . -67.68 -28.31 67.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 113.812 -1.54 . . . . 30.579999999999998 108.915 167.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' HIS . . . . . 0.717 ' HB2' ' HA ' ' B' ' 44' ' ' LYS . 41.7 m170 -82.57 0.8 41.11 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.714 1.259 . . . . 22.010000000000002 109.431 -179.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLU . . . . . 0.757 ' HG3' ' O ' ' B' ' 44' ' ' LYS . 11.5 mt-10 -108.89 -40.15 5.11 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.811 1.944 . . . . 65.319999999999993 110.711 169.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.505 HD22 ' HA ' ' B' ' 46' ' ' ALA . 6.6 m-80 -68.66 -43.8 75.44 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 118.018 -1.473 . . . . 19.48 109.286 178.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -3.73 4.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 C-N-CA 124.557 1.143 . . . . 73.459999999999994 110.404 177.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 55' ' ' ILE . 43.4 t80 -113.25 -3.24 13.89 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.109 1.363 . . . . 40.689999999999998 110.483 172.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' B' ' 48' ' ' GLU . 10.7 mttt -102.47 -18.85 15.15 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 124.978 1.311 . . . . 32.090000000000003 108.938 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . 0.75 ' HA2' ' HD2' ' B' ' 56' ' ' ARG . . . -84.52 -47.5 5.38 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 108.678 -1.769 . . . . 26.420000000000002 108.678 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' MET . . . . . 0.668 ' HB3' ' HG3' ' A' ' 54' ' ' MET . 30.8 mmm -58.59 -22.73 56.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.944 -0.628 . . . . 33.509999999999998 111.991 177.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.492 HG23 ' O ' ' B' ' 51' ' ' PHE . 0.3 OUTLIER -96.24 -12.44 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 114.139 -3.024 . . . . 27.66 107.436 174.325 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ARG . . . . . 0.75 ' HD2' ' HA2' ' B' ' 53' ' ' GLY . 0.0 OUTLIER -54.17 -26.49 28.23 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.155 -0.93 . . . . 58.850000000000001 111.347 176.388 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.39 26.87 0.36 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.799 1.182 . . . . 26.829999999999998 113.322 -176.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . 0.498 ' O ' ' OE1' ' C' ' 48' ' ' GLU . . . -82.5 54.0 4.86 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.324 -1.111 . . . . 30.899999999999999 110.324 175.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . 0.524 ' HA ' ' SD ' ' C' ' 45' ' ' MET . 99.0 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.817 0.341 . . . . 40.960000000000001 111.221 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' VAL . . . . . 0.477 ' N ' ' OE1' ' C' ' 15' ' ' GLN . 1.2 t . . . . . 0 CA--C 1.519 -0.238 0 N-CA-C 110.281 -0.266 . . . . 47.659999999999997 110.281 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -84.95 14.85 4.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.354 -0.384 . . . . 61.399999999999999 111.169 166.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLN . . . . . 0.616 ' O ' ' N ' ' C' ' 17' ' ' ASP . 0.0 OUTLIER -105.82 -54.49 2.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 38.609999999999999 111.182 143.912 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.477 ' OE1' ' N ' ' C' ' 12' ' ' VAL . 4.5 mt-30 -53.7 -30.53 44.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.298 1.047 . . . . 46.880000000000003 111.778 -175.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' PHE . . . . . 0.77 ' O ' ' HG3' ' C' ' 20' ' ' LYS . 4.9 m-30 -67.64 -24.51 65.46 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.326 -1.361 . . . . 26.309999999999999 107.326 175.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ASP . . . . . 0.758 ' O ' ' HB2' ' C' ' 20' ' ' LYS . 57.1 m-20 -81.79 -45.77 15.14 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 117.859 -1.067 . . . . 38.520000000000003 111.134 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' LEU . . . . . 0.827 HD21 ' HG2' ' D' ' 42' ' ' ARG . 6.6 mt -51.72 -58.42 6.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 118.747 0.703 . . . . 37.380000000000003 110.85 -178.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' GLN . . . . . 0.415 ' HA ' ' CD ' ' C' ' 22' ' ' ARG . 75.3 mt-30 -48.09 -40.87 24.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.845 0.831 . . . . 34.119999999999997 110.637 -178.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' LYS . . . . . 0.77 ' HG3' ' O ' ' C' ' 16' ' ' PHE . 13.4 mttt -46.29 -67.67 0.26 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 113.075 -1.875 . . . . 35.979999999999997 110.934 179.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' TYR . . . . . 0.879 ' HA ' ' HG3' ' C' ' 24' ' ' GLN . 0.0 OUTLIER -59.16 -34.39 72.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.513 2.325 . . . . 48.109999999999999 111.152 -176.391 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ARG . . . . . 0.752 ' O ' ' HB2' ' C' ' 26' ' ' ARG . 2.4 mtp180 -67.37 -6.44 18.95 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.053 -0.522 . . . . 27.800000000000001 111.701 -175.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -74.79 -54.45 7.31 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.467 2.307 . . . . 23.100000000000001 109.89 157.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' GLN . . . . . 0.879 ' HG3' ' HA ' ' C' ' 21' ' ' TYR . 8.1 mt-30 -51.67 -70.58 0.08 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.355 -1.293 . . . . 30.84 111.038 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' VAL . . . . . 1.203 ' CG1' HD21 ' C' ' 33' ' ' LEU . 0.0 OUTLIER -44.29 -58.64 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 125.606 1.816 . . . . 37.850000000000001 109.496 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ARG . . . . . 0.752 ' HB2' ' O ' ' C' ' 22' ' ' ARG . 0.5 OUTLIER -43.06 -31.83 0.6 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 113.714 -1.584 . . . . 76.060000000000002 113.065 176.206 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -103.48 -17.28 15.28 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.181 1.393 . . . . 25.98 114.186 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ILE . . . . . 1.4 ' CG2' ' HG ' ' C' ' 33' ' ' LEU . 13.7 tt -73.66 169.93 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-O 122.651 1.215 . . . . 44.670000000000002 112.305 -177.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' SER . . . . . 0.623 ' OG ' ' HB2' ' C' ' 32' ' ' ASP . 0.9 OUTLIER -86.11 -177.2 6.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.176 1.917 . . . . 38.240000000000002 116.176 -167.286 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ARG . . . . . 0.617 ' O ' ' HG3' ' C' ' 34' ' ' GLU . 0.7 OUTLIER -71.85 -28.23 63.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 112.324 -2.217 . . . . 44.829999999999998 110.603 176.306 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' GLU . . . . . 0.713 ' O ' ' HB2' ' C' ' 34' ' ' GLU . 0.0 OUTLIER -103.15 -33.59 9.15 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.372 -0.831 . . . . 16.32 112.352 -179.832 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ASP . . . . . 0.683 ' O ' HD11 ' C' ' 28' ' ' ILE . 11.2 m-20 -78.56 -26.15 45.53 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 130.649 3.579 . . . . 17.510000000000002 113.344 -171.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' LEU . . . . . 1.4 ' HG ' ' CG2' ' C' ' 28' ' ' ILE . 6.8 mt -84.43 -16.09 43.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 117.196 -1.802 . . . . 45.170000000000002 107.59 169.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' GLU . . . . . 0.713 ' HB2' ' O ' ' C' ' 31' ' ' GLU . 13.4 mt-10 -72.58 -53.73 11.11 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 114.592 -1.185 . . . . 68.730000000000004 112.704 -178.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ASP . . . . . 0.475 ' O ' HG12 ' C' ' 38' ' ' ILE . 3.1 m-20 -81.65 15.51 2.11 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 118.92 -2.362 . . . . 53.890000000000001 111.179 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' LEU . . . . . 0.624 ' O ' ' HB2' ' C' ' 39' ' ' GLU . 3.2 mt -94.44 -41.46 9.37 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.896 1.279 . . . . 35.520000000000003 110.603 172.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' PHE . . . . . 1.101 ' CE2' HD22 ' D' ' 33' ' ' LEU . 18.7 m-30 -58.7 -47.03 85.93 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 117.659 -1.616 . . . . 53.700000000000003 109.267 172.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' ILE . . . . . 0.717 ' CD1' HH12 ' D' ' 22' ' ' ARG . 0.5 OUTLIER -49.72 -33.81 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 125.656 1.848 . . . . 30.600000000000001 111.498 174.6 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' GLU . . . . . 0.624 ' HB2' ' O ' ' C' ' 36' ' ' LEU . 5.3 mm-40 -65.06 -81.42 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 126.189 2.181 . . . . 48.850000000000001 110.061 176.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' VAL . . . . . 1.113 HG13 ' HD3' ' D' ' 44' ' ' LYS . 19.0 t -60.74 -13.58 7.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-N 115.747 -0.66 . . . . 41.039999999999999 112.505 -178.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' VAL . . . . . 0.812 ' HA ' ' HZ3' ' C' ' 44' ' ' LYS . 93.7 t -68.49 -37.7 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 112.569 -3.653 . . . . 64.959999999999994 107.401 173.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ARG . . . . . 1.247 ' HG2' ' CD1' ' D' ' 18' ' ' LEU 0.357 85.3 mtt85 -55.51 -26.02 40.55 Favored 'General case' 0 N--CA 1.414 -2.236 0 C-N-CA 118.467 -1.293 . . . . 45.630000000000003 113.818 167.226 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' GLN . . . . . 0.473 ' O ' ' ND1' ' C' ' 47' ' ' HIS . 1.0 OUTLIER -94.28 30.11 2.02 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.427 -0.509 . . . . 28.890000000000001 111.88 171.081 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LYS . . . . . 0.812 ' HZ3' ' HA ' ' C' ' 41' ' ' VAL . 0.0 OUTLIER -119.82 -44.09 2.54 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 119.281 -0.968 . . . . 37.969999999999999 112.03 -174.223 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' MET . . . . . 0.612 ' HE2' ' HG2' ' D' ' 14' ' ' GLN . 0.1 OUTLIER -97.49 -14.19 21.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 122.212 1.006 . . . . 59.579999999999998 109.354 176.02 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.09 68.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 113.849 -1.523 . . . . 65.069999999999993 108.726 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' HIS . . . . . 0.677 ' O ' ' HB ' ' C' ' 50' ' ' ILE . 57.9 m80 -56.13 -29.58 60.91 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 114.722 -1.126 . . . . 44.640000000000001 109.472 173.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' GLU . . . . . 0.556 ' HB2' ' O ' ' C' ' 45' ' ' MET . 13.8 mt-10 -64.29 -14.7 57.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.019 0.748 . . . . 37.979999999999997 113.019 -175.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' ASN . . . . . 0.445 ' OD1' ' NE2' ' D' ' 14' ' ' GLN . 0.0 OUTLIER -112.06 27.28 9.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 123.175 1.464 . . . . 30.170000000000002 107.923 169.036 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' ILE . . . . . 0.677 ' HB ' ' O ' ' C' ' 47' ' ' HIS . 0.1 OUTLIER -100.57 -46.54 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 113.632 -1.622 . . . . 60.259999999999998 109.16 176.575 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' PHE . . . . . 0.612 ' HE1' ' HB ' ' D' ' 50' ' ' ILE . 40.9 m-85 -72.45 -47.62 47.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.643 -1.162 . . . . 25.859999999999999 111.597 171.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' LYS . . . . . 0.776 ' O ' ' HG3' ' C' ' 56' ' ' ARG . 1.7 ttmt -51.05 -70.97 0.07 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.282 1.833 . . . . 52.950000000000003 111.372 -179.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' GLY . . . . . 0.661 ' HA2' ' HD2' ' C' ' 56' ' ' ARG . . . -53.86 -35.84 54.1 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 109.628 -1.389 . . . . 59.939999999999998 109.628 175.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' MET . . . . . 0.686 ' HG3' ' HG3' ' D' ' 54' ' ' MET . 0.0 OUTLIER -53.14 -69.8 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 118.161 -0.923 . . . . 41.579999999999998 109.214 174.429 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ILE . . . . . 0.738 HG12 ' O ' ' C' ' 52' ' ' LYS . 0.1 OUTLIER -48.63 -38.63 9.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 O-C-N 125.702 1.876 . . . . 28.899999999999999 109.525 -177.512 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' ARG . . . . . 0.776 ' HG3' ' O ' ' C' ' 52' ' ' LYS . 51.3 mtt180 -50.67 -49.97 55.85 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 119.324 -0.951 . . . . 19.879999999999999 108.825 174.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLN . . . . . 0.459 ' N ' ' O ' ' C' ' 54' ' ' MET . 79.3 mt-30 -77.09 2.82 14.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.222 -0.899 . . . . 22.289999999999999 112.867 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -110.01 7.84 31.24 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 108.55 -1.82 . . . . 37.979999999999997 108.55 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' SER . . . . . . . . . . . . . 49.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.778 0.323 . . . . 33.920000000000002 111.184 -176.091 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' VAL . . . . . 0.403 ' HB ' ' H ' ' D' ' 13' ' ' GLU . 2.2 t . . . . . 0 C--O 1.234 0.28 0 N-CA-C 111.56 0.207 . . . . 67.060000000000002 111.56 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' D' ' 16' ' ' PHE . 69.5 mt-10 -39.95 -71.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 125.637 1.575 . . . . 47.170000000000002 113.202 -177.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLN . . . . . 0.64 ' O ' ' HB2' ' D' ' 17' ' ' ASP . 87.3 mt-30 -44.09 -61.25 1.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 O-C-N 125.366 1.666 . . . . 59.359999999999999 110.338 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -42.53 -61.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.826 1.329 . . . . 47.25 110.292 173.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' D' ' 13' ' ' GLU . 5.3 m-85 -46.6 -39.61 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 124.146 0.903 . . . . 59.359999999999999 109.561 177.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ASP . . . . . 0.76 ' HA ' ' HE3' ' D' ' 20' ' ' LYS . 1.1 m-20 -61.83 -50.34 72.68 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 115.271 -0.877 . . . . 88.659999999999997 110.088 179.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' LEU . . . . . 1.247 ' CD1' ' HG2' ' C' ' 42' ' ' ARG . 74.3 mt -52.65 -39.07 61.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 125.101 1.501 . . . . 38.270000000000003 112.578 -177.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' GLN . . . . . 0.684 ' O ' ' HB2' ' D' ' 22' ' ' ARG . 35.7 mt-30 -57.99 -50.0 74.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 118.15 -1.42 . . . . 51.119999999999997 109.012 176.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' D' ' 17' ' ' ASP . 5.6 mttt -43.74 -65.7 0.47 Allowed 'General case' 0 C--N 1.323 -0.569 0 O-C-N 125.181 1.55 . . . . 52.329999999999998 110.166 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' TYR . . . . . 0.612 ' CD1' HG11 ' C' ' 41' ' ' VAL . 9.6 m-85 -51.84 -32.5 32.07 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.274 0.559 . . . . 65.900000000000006 110.411 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ARG . . . . . 0.821 ' HG3' ' O ' ' D' ' 18' ' ' LEU . 79.5 mtp85 -61.37 -27.29 68.41 Favored 'General case' 0 N--CA 1.462 0.139 0 C-N-CA 119.844 -0.742 . . . . 54.859999999999999 110.822 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -85.45 -50.47 7.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 119.212 -0.423 . . . . 69.450000000000003 111.329 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -52.99 -57.55 9.97 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 122.069 0.938 . . . . 47.950000000000003 108.889 176.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' VAL . . . . . 0.696 HG11 ' O ' ' C' ' 34' ' ' GLU . 19.5 t -43.6 -35.61 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 112.719 -2.037 . . . . 52.950000000000003 112.668 178.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.57 -4.34 30.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.613 0.72 . . . . 54.549999999999997 111.703 -176.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -124.45 0.34 8.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.701 -0.681 . . . . 63.890000000000001 110.246 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ILE . . . . . 1.565 ' CG2' ' CG ' ' D' ' 33' ' ' LEU . 96.9 mt -64.57 126.84 24.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-O 121.368 0.604 . . . . 49.130000000000003 111.241 -178.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' SER . . . . . 0.523 ' O ' HG22 ' D' ' 28' ' ' ILE . 4.8 p -68.15 169.75 9.75 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.748 -1.115 . . . . 33.640000000000001 108.585 178.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ARG . . . . . 0.686 ' NH2' ' O ' ' D' ' 64' ' ' HOH . 12.3 mtt180 -62.1 -58.23 8.59 Favored 'General case' 0 C--O 1.246 0.874 0 C-N-CA 116.053 -2.259 . . . . 46.909999999999997 111.807 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' GLU . . . . . 0.404 ' H ' ' HG2' ' D' ' 31' ' ' GLU . 0.6 OUTLIER -63.82 -37.22 86.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.536 -1.265 . . . . 66.25 111.292 -176.856 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -57.33 -28.05 62.77 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 119.524 -0.87 . . . . 88.799999999999997 110.486 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' LEU . . . . . 1.565 ' CG ' ' CG2' ' D' ' 28' ' ' ILE . 55.0 mt -89.85 -52.28 5.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.465 1.126 . . . . 70.340000000000003 109.62 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' GLU . . . . . 0.669 ' OE1' ' HA ' ' C' ' 26' ' ' ARG . 16.3 mt-10 -51.23 -22.29 2.59 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.176 -1.577 . . . . 76.859999999999999 113.466 177.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ASP . . . . . 0.75 ' O ' ' HG3' ' D' ' 39' ' ' GLU . 1.6 m-20 -86.02 -39.4 16.88 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.893 0.854 . . . . 56.140000000000001 111.112 172.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' LEU . . . . . 0.751 ' O ' HG23 ' D' ' 40' ' ' VAL . 44.9 mt -59.48 -47.78 84.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 118.107 -1.437 . . . . 38.490000000000002 109.071 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -52.66 -55.59 21.46 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 124.082 0.864 . . . . 57.670000000000002 112.067 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' ILE . . . . . 0.705 HG22 ' HG2' ' C' ' 22' ' ' ARG . 26.1 pt -52.68 -56.69 6.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 O-C-N 125.662 1.851 . . . . 46.329999999999998 108.399 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' GLU . . . . . 0.75 ' HG3' ' O ' ' D' ' 35' ' ' ASP . 52.6 mt-10 -47.4 -39.71 16.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 124.652 1.22 . . . . 63.909999999999997 109.879 178.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' VAL . . . . . 0.751 HG23 ' O ' ' D' ' 36' ' ' LEU . 66.2 t -78.5 -16.05 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 114.546 -1.206 . . . . 60.189999999999998 112.502 -173.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' VAL . . . . . 0.588 HG21 ' CD2' ' C' ' 21' ' ' TYR . 84.3 t -89.48 -26.58 5.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 117.316 -1.754 . . . . 78.579999999999998 109.133 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' ARG . . . . . 0.827 ' HG2' HD21 ' C' ' 18' ' ' LEU . 0.3 OUTLIER -65.17 -3.84 4.32 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 115.516 -0.765 . . . . 104.36 111.111 -178.921 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' GLN . . . . . 0.784 ' C ' ' H ' ' D' ' 45' ' ' MET . 38.1 mt-30 -111.64 -47.76 3.13 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 113.69 -1.596 . . . . 82.400000000000006 114.645 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' LYS . . . . . 1.113 ' HD3' HG13 ' C' ' 40' ' ' VAL . 42.5 mtmt -54.01 -4.88 0.06 Allowed 'General case' 0 C--O 1.165 -3.345 0 N-CA-C 100.568 -3.864 . . . . 90.349999999999994 100.568 -176.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' MET . . . . . 0.784 ' H ' ' C ' ' D' ' 43' ' ' GLN . 78.0 mmm -107.93 -42.78 4.6 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 127.824 2.45 . . . . 67.620000000000005 115.455 -177.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' ALA . . . . . 0.72 ' O ' HD12 ' D' ' 50' ' ' ILE . . . -56.85 -58.6 7.44 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.948 -1.095 . . . . 63.869999999999997 109.536 164.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' HIS . . . . . 0.512 ' HA ' ' HZ ' ' C' ' 51' ' ' PHE . 29.9 m80 -47.55 -38.21 13.8 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 124.368 1.042 . . . . 39.829999999999998 110.745 177.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.75 -39.56 94.57 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.249 0.968 . . . . 55.479999999999997 110.951 175.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' D' ' 52' ' ' LYS . 18.2 m-20 -61.66 -53.81 51.12 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.242 1.017 . . . . 52.57 112.657 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' ILE . . . . . 0.72 HD12 ' O ' ' D' ' 46' ' ' ALA . 4.8 mp -64.83 -25.99 39.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.624 -1.171 . . . . 45.0 111.588 178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' PHE . . . . . 0.747 ' HA ' ' HB2' ' D' ' 54' ' ' MET . 51.5 t80 -89.6 -5.57 57.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.892 0.853 . . . . 51.280000000000001 109.181 175.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' LYS . . . . . 0.774 ' O ' ' HG3' ' D' ' 56' ' ' ARG . 30.2 mttt -83.83 -53.66 5.44 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 113.364 -1.744 . . . . 30.420000000000002 106.701 166.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' GLY . . . . . 0.622 ' HA2' ' HD2' ' D' ' 56' ' ' ARG . . . -59.87 -23.95 59.68 Favored Glycine 0 C--O 1.247 0.959 0 CA-C-N 114.189 -1.369 . . . . 54.079999999999998 110.969 172.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' MET . . . . . 0.747 ' HB2' ' HA ' ' D' ' 51' ' ' PHE . 0.0 OUTLIER -73.63 -40.84 63.48 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.644 0.378 . . . . 149.53999999999999 111.129 177.607 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' ILE . . . . . 0.532 HG12 ' O ' ' D' ' 51' ' ' PHE . 0.0 OUTLIER -74.4 -26.29 20.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 120.201 -0.6 . . . . 54.539999999999999 110.757 177.215 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' ARG . . . . . 0.774 ' HG3' ' O ' ' D' ' 52' ' ' LYS . 83.2 mtt180 -60.56 -17.43 46.14 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.778 1.231 . . . . 55.57 112.201 -176.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -83.02 60.07 5.27 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 108.298 -1.001 . . . . 34.640000000000001 108.298 172.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' GLY . . . . . . . . . . . . . . . -115.99 24.32 10.16 Favored Glycine 0 CA--C 1.531 1.075 0 O-C-N 125.203 1.564 . . . . 46.619999999999997 109.202 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 50.520000000000003 111.245 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' HOH . . . . . 0.466 ' O ' ' NE2' ' B' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' HOH . . . . . 0.686 ' O ' ' NH2' ' D' ' 30' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_