data_3zf1_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 3zf1 _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 ' 2' ' ' THR . . . . . 0.783 ' CA ' ' O ' ' A' 2001 ' ' HOH . 0.5 OUTLIER . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.414 0.626 . . . . 115.92 109.685 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' N ' ' OG1' ' A' ' 2' ' ' THR . 21.3 t-20 -99.06 34.97 1.99 Allowed 'General case' 0 CA--C 1.482 -1.649 0 N-CA-C 106.038 -1.838 . . . . 111.28 106.038 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.6 p -128.27 148.55 50.65 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.395 -1.275 . . . . 102.52 109.954 174.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 tp -110.38 136.32 49.73 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.994 -0.548 . . . . 93.0 110.622 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -85.1 125.87 33.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.837 -0.619 . . . . 94.079999999999998 111.351 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.4 t -124.29 133.64 68.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.846 -0.615 . . . . 78.859999999999999 109.432 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -124.76 129.25 50.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.364 -0.38 . . . . 77.370000000000005 111.182 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt -88.77 134.52 33.9 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.356 -0.609 . . . . 77.650000000000006 109.356 174.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.7 mt -102.0 -10.1 20.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.355 0.872 . . . . 75.25 113.355 -174.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.6 p -156.07 178.24 10.51 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.907 0.336 . . . . 75.260000000000005 111.907 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -73.33 -22.98 60.19 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.036 -0.529 . . . . 76.290000000000006 111.596 175.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -81.34 -9.84 59.67 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.551 0.945 . . . . 74.480000000000004 113.551 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.57 140.56 34.42 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.416 -0.357 . . . . 73.579999999999998 111.582 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -114.29 145.88 41.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.963 -0.562 . . . . 74.239999999999995 110.421 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 tpp -70.84 127.22 92.01 Favored Pre-proline 0 C--O 1.234 0.282 0 CA-C-N 115.694 -0.685 . . . . 80.180000000000007 110.493 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -54.43 147.23 48.18 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.409 2.073 . . . . 82.370000000000005 112.636 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -130.1 129.47 43.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 112.658 0.614 . . . . 91.519999999999996 112.658 -173.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.0 ttt-85 -117.31 74.98 0.95 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.07 -1.455 . . . . 97.560000000000002 107.07 171.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -55.12 -38.64 68.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 115.035 1.494 . . . . 104.98 115.035 -174.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -109.9 143.14 40.23 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 123.28 0.362 . . . . 117.7 111.414 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -74.71 -7.08 52.19 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.04 -0.527 . . . . 107.01000000000001 109.792 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -76.55 -35.21 58.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.288 1.035 . . . . 104.97 110.346 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -71.73 148.08 46.74 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 113.277 0.843 . . . . 95.150000000000006 113.277 -176.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.49 -26.57 18.74 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.978 0.732 . . . . 83.480000000000004 112.978 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -117.58 -176.48 17.32 Favored Glycine 0 C--N 1.331 0.264 0 N-CA-C 115.807 1.083 . . . . 76.890000000000001 115.807 -173.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -121.44 125.69 47.49 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.271 0.628 . . . . 81.340000000000003 110.07 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -62.1 120.17 10.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.005 -0.543 . . . . 70.670000000000002 112.184 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.2 mm -102.98 129.22 55.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.03 -0.532 . . . . 63.590000000000003 110.601 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -107.63 143.71 35.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.704 -0.68 . . . . 59.880000000000003 111.614 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -72.63 138.85 47.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 62.829999999999998 110.822 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.06 7.22 44.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 62.950000000000003 110.525 173.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -126.13 157.97 36.71 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.725 -0.67 . . . . 71.459999999999994 112.391 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.1 m -119.1 111.52 18.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.508 -1.293 . . . . 61.520000000000003 107.508 167.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.0 m -134.65 150.04 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 112.612 0.597 . . . . 61.490000000000002 112.612 -177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.2 t -108.99 120.94 61.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 108.941 -0.763 . . . . 55.479999999999997 108.941 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -103.59 115.89 31.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 52.189999999999998 111.847 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.65 162.12 71.72 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.874 -0.603 . . . . 58.369999999999997 110.187 174.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.06 136.87 53.74 Favored 'Trans proline' 0 C--N 1.35 0.631 0 O-C-N 122.524 0.749 . . . . 53.43 113.178 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . 0.862 ' NE2' ' O ' ' A' 2009 ' ' HOH . 27.9 mm100 69.66 -2.77 1.85 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.295 1.591 . . . . 56.759999999999998 115.295 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -76.44 137.12 39.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.852 0.358 . . . . 69.5 111.912 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -108.64 149.31 29.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.643 -0.708 . . . . 57.329999999999998 110.339 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.18 159.01 33.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.424 0.528 . . . . 61.210000000000001 112.424 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.0 t -115.22 108.48 25.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 108.05 -1.093 . . . . 58.68 108.05 171.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mm -82.99 123.69 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.985 -0.552 . . . . 64.670000000000002 111.222 -175.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -75.2 132.04 40.84 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.016 -0.538 . . . . 75.599999999999994 111.065 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . 1.032 ' O ' ' O ' ' A' 2007 ' ' HOH . 68.7 p -99.17 -16.74 18.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 66.099999999999994 109.991 174.345 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 54.27 37.74 27.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.058 0.943 . . . . 66.629999999999995 112.166 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.3 t -128.15 139.7 51.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.349 -0.841 . . . . 67.890000000000001 109.266 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.41 137.69 54.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.274 -0.421 . . . . 66.090000000000003 110.931 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . 0.4 ' N ' ' O ' ' A' 2013 ' ' HOH . 14.4 m -123.76 145.77 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.131 -0.486 . . . . 70.209999999999994 111.66 179.091 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 t -112.84 80.16 1.32 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.122 0.487 . . . . 71.670000000000002 110.635 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.39 126.99 91.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.509 -0.769 . . . . 71.530000000000001 109.543 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.52 157.36 59.14 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 121.969 1.779 . . . . 70.700000000000003 111.808 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -61.94 148.49 43.48 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.532 0.52 . . . . 66.030000000000001 111.115 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.4 4.85 63.92 Favored Glycine 0 C--N 1.33 0.241 0 CA-C-N 115.802 -0.636 . . . . 77.739999999999995 111.925 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.38 152.05 51.06 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 122.774 0.429 . . . . 86.620000000000005 111.375 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.59 144.38 33.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.909 -0.587 . . . . 72.060000000000002 109.535 170.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.04 136.71 12.83 Favored Glycine 0 N--CA 1.458 0.126 0 N-CA-C 110.875 -0.89 . . . . 64.590000000000003 110.875 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.5 mt -113.23 98.91 7.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 59.289999999999999 110.314 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tt -80.84 93.38 6.25 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.138 -1.43 . . . . 57.450000000000003 107.138 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.6 t -119.89 171.45 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 114.246 1.202 . . . . 56.890000000000001 114.246 -168.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -77.87 151.7 33.72 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.38 0.881 . . . . 63.210000000000001 113.38 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -83.31 149.53 26.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.259 -0.882 . . . . 86.640000000000001 108.973 168.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 78.2 p -72.77 -33.34 66.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.205 0.817 . . . . 62.909999999999997 113.205 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.09 -43.34 93.54 Favored Glycine 0 N--CA 1.462 0.382 0 CA-C-N 116.399 -0.364 . . . . 56.93 113.674 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . 0.536 ' CG1' ' O ' ' A' 2016 ' ' HOH . 12.3 p -76.06 -38.26 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 112.652 0.612 . . . . 57.229999999999997 112.652 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.9 p -75.52 -30.19 59.71 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.682 0.993 . . . . 57.539999999999999 113.682 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 93.0 p -81.57 -28.18 33.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.199 0.444 . . . . 54.640000000000001 112.199 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -92.51 -36.98 12.76 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.757 1.021 . . . . 58.530000000000001 113.757 -175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.2 p -112.32 165.72 11.93 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 111.924 0.342 . . . . 54.289999999999999 111.924 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -83.41 9.86 10.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.105 -0.498 . . . . 54.689999999999998 112.178 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.79 109.79 5.9 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.861 0.464 . . . . 47.890000000000001 111.407 177.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.5 t -105.74 118.79 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 45.649999999999999 109.926 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 97.4 mt -103.63 116.99 48.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.815 -0.629 . . . . 50.759999999999998 110.996 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -78.06 112.01 14.55 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.617 -0.882 . . . . 55.369999999999997 108.617 174.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.3 m -51.38 127.41 19.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.703 -0.68 . . . . 54.609999999999999 110.852 -177.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -97.6 136.29 12.66 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.014 -0.539 . . . . 57.030000000000001 111.84 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.74 102.55 14.44 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.888 -0.412 . . . . 58.770000000000003 109.888 178.166 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.6 mm -79.66 108.98 13.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 115.974 -0.557 . . . . 66.299999999999997 110.107 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -67.4 140.3 57.17 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.621 -0.718 . . . . 76.260000000000005 112.675 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.35 96.04 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.568 -0.742 . . . . 77.450000000000003 110.777 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 136.94 -18.44 3.56 Favored Glycine 0 N--CA 1.461 0.31 0 CA-C-N 115.908 -0.587 . . . . 77.920000000000002 112.888 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -69.18 116.97 10.24 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 122.608 0.363 . . . . 77.790000000000006 110.416 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -111.19 14.5 21.76 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.77 0.656 . . . . 86.349999999999994 112.77 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.63 -177.48 51.95 Favored Glycine 0 N--CA 1.461 0.333 0 CA-C-N 116.329 -0.396 . . . . 73.680000000000007 113.779 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.33 124.79 24.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.662 0.385 . . . . 64.680000000000007 111.354 179.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -70.68 114.4 8.73 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.185 -0.461 . . . . 62.159999999999997 110.209 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.18 156.52 20.0 Favored Glycine 0 N--CA 1.459 0.175 0 N-CA-C 111.258 -0.737 . . . . 59.549999999999997 111.258 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 88.6 mt -112.1 108.31 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.327 0.584 . . . . 54.82 110.017 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -75.06 97.28 3.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.006 -0.997 . . . . 56.710000000000001 109.947 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 11.0 tt -121.01 154.49 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.816 -0.629 . . . . 50.469999999999999 112.671 -170.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . 0.776 ' NZ ' ' O ' ' A' 2009 ' ' HOH . 62.1 tttt -148.06 130.05 15.34 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.655 -0.702 . . . . 49.5 109.971 174.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . 0.768 ' O ' ' O ' ' A' 2008 ' ' HOH . 43.1 t-20 -81.27 99.82 8.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.415 -0.958 . . . . 52.259999999999998 108.415 171.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -83.5 7.05 18.23 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.764 1.024 . . . . 55.310000000000002 113.764 -172.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -61.54 142.13 57.28 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.32 -0.992 . . . . 55.619999999999997 108.32 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -72.0 151.49 43.17 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 115.4 -2.52 . . . . 59.420000000000002 110.681 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -93.86 85.91 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.163 -0.926 . . . . 67.200000000000003 109.092 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -90.58 14.41 13.29 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.901 1.075 . . . . 80.480000000000004 113.901 -174.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.08 -14.85 0.17 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.52 1.674 . . . . 85.829999999999998 115.52 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.17 155.25 40.71 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.737 0.643 . . . . 101.92 112.737 177.895 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -129.48 147.87 51.34 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.826 0.676 . . . . 95.0 112.826 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 9.7 t -134.58 158.93 42.74 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.939 -0.573 . . . . 77.739999999999995 111.446 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.3 pt -84.53 -4.87 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 113.892 1.071 . . . . 78.540000000000006 113.892 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.85 135.67 23.44 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 114.248 1.203 . . . . 87.230000000000004 114.248 176.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.26 171.59 12.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.215 -0.902 . . . . 74.189999999999998 109.551 172.007 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.86 150.41 46.47 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 114.372 1.249 . . . . 74.109999999999999 114.372 -176.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -80.43 -175.13 5.0 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.943 1.09 . . . . 61.200000000000003 113.943 -175.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.6 pt -75.91 4.59 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 112.951 0.723 . . . . 59.229999999999997 112.951 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.0 10.28 26.25 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.266 -0.425 . . . . 69.579999999999998 110.316 169.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 65.15 10.29 6.25 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.479 1.288 . . . . 72.120000000000005 114.479 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.7 141.95 29.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 78.599999999999994 111.196 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -66.96 131.32 45.64 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.912 -0.585 . . . . 83.709999999999994 111.776 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 78.9 mt -95.74 111.58 26.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.087 -0.506 . . . . 86.730000000000004 110.317 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -79.32 129.61 34.63 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.869 -0.605 . . . . 93.400000000000006 111.01 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -114.15 152.29 31.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 95.709999999999994 111.84 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . . . -71.64 -38.4 70.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.977 -0.556 . . . . 94.450000000000003 110.786 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -100.72 134.89 43.01 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.057 -0.52 . . . . 98.25 109.77 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ARG . . . . . 0.789 ' CA ' ' O ' ' A' 2029 ' ' HOH . 0.0 OUTLIER -76.52 136.18 39.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.562 -0.903 . . . . 105.48999999999999 108.562 179.474 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -143.37 146.57 33.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.228 -0.896 . . . . 97.280000000000001 108.672 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 19.9 mt -99.36 109.08 21.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.282 0.475 . . . . 87.129999999999995 112.282 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -107.45 157.68 17.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.824 -0.625 . . . . 78.950000000000003 109.801 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -74.56 142.28 44.71 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.851 -0.426 . . . . 74.709999999999994 109.851 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.21 128.35 35.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.507 -0.315 . . . . 66.340000000000003 111.432 -175.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.03 12.34 46.5 Favored Glycine 0 N--CA 1.462 0.417 0 CA-C-N 115.92 -0.582 . . . . 62.740000000000002 113.805 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.5 m -79.73 138.69 37.38 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.754 0.312 . . . . 59.960000000000001 111.513 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -119.59 150.43 40.3 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.711 -0.677 . . . . 60.770000000000003 111.603 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -121.73 129.62 52.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.459999999999994 110.436 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.1 mt -104.87 132.14 52.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.283 -1.377 . . . . 63.32 107.283 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -109.1 155.41 21.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.07 0.767 . . . . 76.25 113.07 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -57.53 122.47 12.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.185 -0.916 . . . . 74.409999999999997 111.903 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.46 25.16 31.4 Favored Glycine 0 N--CA 1.461 0.309 0 N-CA-C 114.919 0.727 . . . . 66.409999999999997 114.919 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -100.36 143.03 31.03 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.89 1.07 . . . . 67.5 113.89 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.33 98.88 2.78 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.724 0.81 . . . . 83.590000000000003 109.621 175.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 34.0 pt -118.4 -20.92 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 113.893 1.072 . . . . 71.189999999999998 113.893 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.79 173.09 11.83 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.328 -0.396 . . . . 65.599999999999994 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -143.36 150.54 39.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.083 -0.508 . . . . 65.769999999999996 111.905 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.93 124.08 50.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 61.799999999999997 111.333 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 40.9 t -123.49 121.71 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.199 -0.455 . . . . 58.939999999999998 109.922 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.79 127.82 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.834 0.349 . . . . 60.25 110.738 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.0 t -129.12 134.83 26.75 Favored Pre-proline 0 CA--C 1.534 0.337 0 C-N-CA 123.342 0.657 . . . . 64.269999999999996 109.624 -174.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.4 148.55 90.12 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.781 2.321 . . . . 68.930000000000007 112.793 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 pt -133.31 148.99 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.328 0.862 . . . . 75.650000000000006 113.328 -178.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' TRP . . . . . 0.538 ' CD1' ' O ' ' A' 2035 ' ' HOH . 21.4 t90 -108.08 114.17 27.87 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.66 -0.7 . . . . 87.359999999999999 109.52 176.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.3 p -119.59 78.67 21.4 Favored Pre-proline 0 C--O 1.236 0.38 0 N-CA-C 112.556 0.576 . . . . 85.200000000000003 112.556 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -82.17 165.11 17.09 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 120.996 1.131 . . . . 83.799999999999997 112.558 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . . . -73.05 141.77 47.62 Favored 'General case' 0 C--O 1.234 0.26 0 O-C-N 123.286 0.366 . . . . 89.090000000000003 110.118 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.63 134.33 33.92 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.342 -0.39 . . . . 90.890000000000001 111.846 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . . . -126.37 113.78 17.35 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.813 -0.63 . . . . 86.0 110.741 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -64.45 125.6 25.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.228 -0.442 . . . . 82.099999999999994 110.553 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 4.0 t -128.15 142.54 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.484 -0.78 . . . . 80.849999999999994 110.032 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -86.26 -29.79 22.83 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.927 -0.579 . . . . 84.239999999999995 112.363 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -156.85 132.86 9.64 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.03 -0.73 . . . . 98.040000000000006 109.03 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -60.45 158.34 12.27 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 115.156 1.539 . . . . 101.2 115.156 -171.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -44.36 -54.57 5.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.097 1.147 . . . . 111.65000000000001 114.097 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.399 -0.364 . . . . 107.78 111.316 -179.176 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 777' ' ' DUP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1157 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1158 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . 0.783 ' O ' ' CA ' ' A' ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . 1.032 ' O ' ' O ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . 0.768 ' O ' ' O ' ' A' ' 94' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . 0.862 ' O ' ' NE2' ' A' ' 40' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . 0.4 ' O ' ' N ' ' A' ' 51' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . 0.536 ' O ' ' CG1' ' A' ' 67' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2029 ' ' HOH . . . . . 0.789 ' O ' ' CA ' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2032 ' ' HOH . . . . . 0.561 ' O ' ' NH2' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2035 ' ' HOH . . . . . 0.538 ' O ' ' CD1' ' A' ' 144' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 1.125 ' HA ' ' O ' ' A' 2001 ' ' HOH . 0.5 OUTLIER . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.414 0.626 . . . . 115.92 109.685 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' N ' ' OG1' ' A' ' 2' ' ' THR . 21.3 t-20 -99.06 34.97 1.99 Allowed 'General case' 0 CA--C 1.482 -1.649 0 N-CA-C 106.038 -1.838 . . . . 111.28 106.038 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.6 p -128.27 148.55 50.65 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.395 -1.275 . . . . 102.52 109.954 174.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 tp -110.38 136.32 49.73 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.994 -0.548 . . . . 93.0 110.622 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -85.1 125.87 33.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.837 -0.619 . . . . 94.079999999999998 111.351 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.4 t -124.29 133.64 68.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.846 -0.615 . . . . 78.859999999999999 109.432 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -124.76 129.25 50.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.364 -0.38 . . . . 77.370000000000005 111.182 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt -88.77 134.52 33.9 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.356 -0.609 . . . . 77.650000000000006 109.356 174.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.7 mt -102.0 -10.1 20.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.355 0.872 . . . . 75.25 113.355 -174.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.6 p -156.07 178.24 10.51 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.907 0.336 . . . . 75.260000000000005 111.907 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . 0.767 ' HG2' ' O ' ' A' 2004 ' ' HOH . 50.4 pttt -73.33 -22.98 60.19 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.036 -0.529 . . . . 76.290000000000006 111.596 175.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -81.34 -9.84 59.67 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.551 0.945 . . . . 74.480000000000004 113.551 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.57 140.56 34.42 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.416 -0.357 . . . . 73.579999999999998 111.582 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -114.29 145.88 41.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.963 -0.562 . . . . 74.239999999999995 110.421 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 tpp -70.84 127.22 92.01 Favored Pre-proline 0 C--O 1.234 0.282 0 CA-C-N 115.694 -0.685 . . . . 80.180000000000007 110.493 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -54.43 147.23 48.18 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.409 2.073 . . . . 82.370000000000005 112.636 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -130.1 129.47 43.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 112.658 0.614 . . . . 91.519999999999996 112.658 -173.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.0 ttt-85 -117.31 74.98 0.95 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.07 -1.455 . . . . 97.560000000000002 107.07 171.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -55.12 -38.64 68.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 115.035 1.494 . . . . 104.98 115.035 -174.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -109.9 143.14 40.23 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 123.28 0.362 . . . . 117.7 111.414 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -74.71 -7.08 52.19 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.04 -0.527 . . . . 107.01000000000001 109.792 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -76.55 -35.21 58.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.288 1.035 . . . . 104.97 110.346 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -71.73 148.08 46.74 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 113.277 0.843 . . . . 95.150000000000006 113.277 -176.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.49 -26.57 18.74 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.978 0.732 . . . . 83.480000000000004 112.978 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -117.58 -176.48 17.32 Favored Glycine 0 C--N 1.331 0.264 0 N-CA-C 115.807 1.083 . . . . 76.890000000000001 115.807 -173.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -121.44 125.69 47.49 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.271 0.628 . . . . 81.340000000000003 110.07 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -62.1 120.17 10.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.005 -0.543 . . . . 70.670000000000002 112.184 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.2 mm -102.98 129.22 55.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.03 -0.532 . . . . 63.590000000000003 110.601 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -107.63 143.71 35.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.704 -0.68 . . . . 59.880000000000003 111.614 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -72.63 138.85 47.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 62.829999999999998 110.822 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.06 7.22 44.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 62.950000000000003 110.525 173.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -126.13 157.97 36.71 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.725 -0.67 . . . . 71.459999999999994 112.391 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.1 m -119.1 111.52 18.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.508 -1.293 . . . . 61.520000000000003 107.508 167.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 45' ' ' ILE . 2.0 m -134.65 150.04 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 112.612 0.597 . . . . 61.490000000000002 112.612 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.2 t -108.99 120.94 61.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 108.941 -0.763 . . . . 55.479999999999997 108.941 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -103.59 115.89 31.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 52.189999999999998 111.847 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.65 162.12 71.72 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.874 -0.603 . . . . 58.369999999999997 110.187 174.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.06 136.87 53.74 Favored 'Trans proline' 0 C--N 1.35 0.631 0 O-C-N 122.524 0.749 . . . . 53.43 113.178 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . 0.862 ' NE2' ' O ' ' A' 2009 ' ' HOH . 27.9 mm100 69.66 -2.77 1.85 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.295 1.591 . . . . 56.759999999999998 115.295 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -76.44 137.12 39.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.852 0.358 . . . . 69.5 111.912 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -108.64 149.31 29.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.643 -0.708 . . . . 57.329999999999998 110.339 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.18 159.01 33.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.424 0.528 . . . . 61.210000000000001 112.424 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.0 t -115.22 108.48 25.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 108.05 -1.093 . . . . 58.68 108.05 171.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . 0.423 HD12 HG21 ' A' ' 35' ' ' VAL . 9.6 mm -82.99 123.69 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.985 -0.552 . . . . 64.670000000000002 111.222 -175.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -75.2 132.04 40.84 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.016 -0.538 . . . . 75.599999999999994 111.065 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 1.032 ' O ' ' O ' ' A' 2007 ' ' HOH . 68.7 p -99.17 -16.74 18.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 66.099999999999994 109.991 174.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 54.27 37.74 27.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.058 0.943 . . . . 66.629999999999995 112.166 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.3 t -128.15 139.7 51.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.349 -0.841 . . . . 67.890000000000001 109.266 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.41 137.69 54.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.274 -0.421 . . . . 66.090000000000003 110.931 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -123.76 145.77 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.131 -0.486 . . . . 70.209999999999994 111.66 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 t -112.84 80.16 1.32 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.122 0.487 . . . . 71.670000000000002 110.635 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.39 126.99 91.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.509 -0.769 . . . . 71.530000000000001 109.543 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.52 157.36 59.14 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 121.969 1.779 . . . . 70.700000000000003 111.808 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -61.94 148.49 43.48 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.532 0.52 . . . . 66.030000000000001 111.115 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.4 4.85 63.92 Favored Glycine 0 C--N 1.33 0.241 0 CA-C-N 115.802 -0.636 . . . . 77.739999999999995 111.925 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.38 152.05 51.06 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 122.774 0.429 . . . . 86.620000000000005 111.375 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.59 144.38 33.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.909 -0.587 . . . . 72.060000000000002 109.535 170.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.04 136.71 12.83 Favored Glycine 0 N--CA 1.458 0.126 0 N-CA-C 110.875 -0.89 . . . . 64.590000000000003 110.875 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.5 mt -113.23 98.91 7.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 59.289999999999999 110.314 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tt -80.84 93.38 6.25 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.138 -1.43 . . . . 57.450000000000003 107.138 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.6 t -119.89 171.45 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 114.246 1.202 . . . . 56.890000000000001 114.246 -168.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -77.87 151.7 33.72 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.38 0.881 . . . . 63.210000000000001 113.38 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -83.31 149.53 26.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.259 -0.882 . . . . 86.640000000000001 108.973 168.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 78.2 p -72.77 -33.34 66.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.205 0.817 . . . . 62.909999999999997 113.205 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.09 -43.34 93.54 Favored Glycine 0 N--CA 1.462 0.382 0 CA-C-N 116.399 -0.364 . . . . 56.93 113.674 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.536 ' CG1' ' O ' ' A' 2016 ' ' HOH . 12.3 p -76.06 -38.26 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 112.652 0.612 . . . . 57.229999999999997 112.652 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.9 p -75.52 -30.19 59.71 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.682 0.993 . . . . 57.539999999999999 113.682 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 93.0 p -81.57 -28.18 33.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.199 0.444 . . . . 54.640000000000001 112.199 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -92.51 -36.98 12.76 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.757 1.021 . . . . 58.530000000000001 113.757 -175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.2 p -112.32 165.72 11.93 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 111.924 0.342 . . . . 54.289999999999999 111.924 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -83.41 9.86 10.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.105 -0.498 . . . . 54.689999999999998 112.178 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.79 109.79 5.9 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.861 0.464 . . . . 47.890000000000001 111.407 177.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.5 t -105.74 118.79 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 45.649999999999999 109.926 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 97.4 mt -103.63 116.99 48.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.815 -0.629 . . . . 50.759999999999998 110.996 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -78.06 112.01 14.55 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.617 -0.882 . . . . 55.369999999999997 108.617 174.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.3 m -51.38 127.41 19.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.703 -0.68 . . . . 54.609999999999999 110.852 -177.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' 2021 ' ' HOH . . . -97.6 136.29 12.66 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.014 -0.539 . . . . 57.030000000000001 111.84 178.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HD2' ' O ' ' A' 2021 ' ' HOH . 0.5 OUTLIER -94.74 102.55 14.44 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.888 -0.412 . . . . 58.770000000000003 109.888 178.166 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.6 mm -79.66 108.98 13.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 115.974 -0.557 . . . . 66.299999999999997 110.107 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASN . . . . . 0.53 ' HB3' ' O ' ' A' 2022 ' ' HOH . 74.9 m-20 -67.4 140.3 57.17 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.621 -0.718 . . . . 76.260000000000005 112.675 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.35 96.04 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.568 -0.742 . . . . 77.450000000000003 110.777 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 136.94 -18.44 3.56 Favored Glycine 0 N--CA 1.461 0.31 0 CA-C-N 115.908 -0.587 . . . . 77.920000000000002 112.888 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -69.18 116.97 10.24 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 122.608 0.363 . . . . 77.790000000000006 110.416 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -111.19 14.5 21.76 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.77 0.656 . . . . 86.349999999999994 112.77 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.63 -177.48 51.95 Favored Glycine 0 N--CA 1.461 0.333 0 CA-C-N 116.329 -0.396 . . . . 73.680000000000007 113.779 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -69.33 124.79 24.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.662 0.385 . . . . 64.680000000000007 111.354 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -70.68 114.4 8.73 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.185 -0.461 . . . . 62.159999999999997 110.209 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.18 156.52 20.0 Favored Glycine 0 N--CA 1.459 0.175 0 N-CA-C 111.258 -0.737 . . . . 59.549999999999997 111.258 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 88.6 mt -112.1 108.31 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.327 0.584 . . . . 54.82 110.017 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -75.06 97.28 3.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.006 -0.997 . . . . 56.710000000000001 109.947 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 11.0 tt -121.01 154.49 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.816 -0.629 . . . . 50.469999999999999 112.671 -170.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . 0.804 ' HE2' ' O ' ' A' 2009 ' ' HOH . 62.1 tttt -148.06 130.05 15.34 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.655 -0.702 . . . . 49.5 109.971 174.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . 0.768 ' O ' ' O ' ' A' 2008 ' ' HOH . 43.1 t-20 -81.27 99.82 8.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.415 -0.958 . . . . 52.259999999999998 108.415 171.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -83.5 7.05 18.23 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.764 1.024 . . . . 55.310000000000002 113.764 -172.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -61.54 142.13 57.28 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.32 -0.992 . . . . 55.619999999999997 108.32 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -72.0 151.49 43.17 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 115.4 -2.52 . . . . 59.420000000000002 110.681 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -93.86 85.91 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.163 -0.926 . . . . 67.200000000000003 109.092 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' 2026 ' ' HOH . 17.9 p-10 -90.58 14.41 13.29 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.901 1.075 . . . . 80.480000000000004 113.901 -174.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.08 -14.85 0.17 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.52 1.674 . . . . 85.829999999999998 115.52 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.17 155.25 40.71 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.737 0.643 . . . . 101.92 112.737 177.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -129.48 147.87 51.34 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.826 0.676 . . . . 95.0 112.826 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 9.7 t -134.58 158.93 42.74 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.939 -0.573 . . . . 77.739999999999995 111.446 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.3 pt -84.53 -4.87 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 113.892 1.071 . . . . 78.540000000000006 113.892 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.85 135.67 23.44 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 114.248 1.203 . . . . 87.230000000000004 114.248 176.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.26 171.59 12.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.215 -0.902 . . . . 74.189999999999998 109.551 172.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.86 150.41 46.47 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 114.372 1.249 . . . . 74.109999999999999 114.372 -176.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -80.43 -175.13 5.0 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.943 1.09 . . . . 61.200000000000003 113.943 -175.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.6 pt -75.91 4.59 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 112.951 0.723 . . . . 59.229999999999997 112.951 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.0 10.28 26.25 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.266 -0.425 . . . . 69.579999999999998 110.316 169.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 52.8 t30 65.15 10.29 6.25 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.479 1.288 . . . . 72.120000000000005 114.479 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.7 141.95 29.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 78.599999999999994 111.196 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -66.96 131.32 45.64 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.912 -0.585 . . . . 83.709999999999994 111.776 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 78.9 mt -95.74 111.58 26.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.087 -0.506 . . . . 86.730000000000004 110.317 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -79.32 129.61 34.63 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.869 -0.605 . . . . 93.400000000000006 111.01 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -114.15 152.29 31.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 95.709999999999994 111.84 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . . . -71.64 -38.4 70.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.977 -0.556 . . . . 94.450000000000003 110.786 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -100.72 134.89 43.01 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.057 -0.52 . . . . 98.25 109.77 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ARG . . . . . 1.217 ' HA ' ' O ' ' A' 2029 ' ' HOH . 0.0 OUTLIER -76.52 136.18 39.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.562 -0.903 . . . . 105.48999999999999 108.562 179.474 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -143.37 146.57 33.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.228 -0.896 . . . . 97.280000000000001 108.672 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 19.9 mt -99.36 109.08 21.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.282 0.475 . . . . 87.129999999999995 112.282 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -107.45 157.68 17.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.824 -0.625 . . . . 78.950000000000003 109.801 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -74.56 142.28 44.71 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.851 -0.426 . . . . 74.709999999999994 109.851 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.21 128.35 35.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.507 -0.315 . . . . 66.340000000000003 111.432 -175.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.03 12.34 46.5 Favored Glycine 0 N--CA 1.462 0.417 0 CA-C-N 115.92 -0.582 . . . . 62.740000000000002 113.805 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.5 m -79.73 138.69 37.38 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.754 0.312 . . . . 59.960000000000001 111.513 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -119.59 150.43 40.3 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.711 -0.677 . . . . 60.770000000000003 111.603 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -121.73 129.62 52.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.459999999999994 110.436 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.1 mt -104.87 132.14 52.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.283 -1.377 . . . . 63.32 107.283 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -109.1 155.41 21.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.07 0.767 . . . . 76.25 113.07 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -57.53 122.47 12.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.185 -0.916 . . . . 74.409999999999997 111.903 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.46 25.16 31.4 Favored Glycine 0 N--CA 1.461 0.309 0 N-CA-C 114.919 0.727 . . . . 66.409999999999997 114.919 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -100.36 143.03 31.03 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.89 1.07 . . . . 67.5 113.89 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ARG . . . . . 0.753 HH11 ' HG3' ' A' ' 134' ' ' ARG . 0.0 OUTLIER -73.33 98.88 2.78 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.724 0.81 . . . . 83.590000000000003 109.621 175.745 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 34.0 pt -118.4 -20.92 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 113.893 1.072 . . . . 71.189999999999998 113.893 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.79 173.09 11.83 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.328 -0.396 . . . . 65.599999999999994 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -143.36 150.54 39.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.083 -0.508 . . . . 65.769999999999996 111.905 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.93 124.08 50.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 61.799999999999997 111.333 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 40.9 t -123.49 121.71 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.199 -0.455 . . . . 58.939999999999998 109.922 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.79 127.82 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.834 0.349 . . . . 60.25 110.738 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.0 t -129.12 134.83 26.75 Favored Pre-proline 0 CA--C 1.534 0.337 0 C-N-CA 123.342 0.657 . . . . 64.269999999999996 109.624 -174.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.4 148.55 90.12 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.781 2.321 . . . . 68.930000000000007 112.793 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 pt -133.31 148.99 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.328 0.862 . . . . 75.650000000000006 113.328 -178.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' TRP . . . . . 0.803 ' HD1' ' O ' ' A' 2035 ' ' HOH . 21.4 t90 -108.08 114.17 27.87 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.66 -0.7 . . . . 87.359999999999999 109.52 176.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.3 p -119.59 78.67 21.4 Favored Pre-proline 0 C--O 1.236 0.38 0 N-CA-C 112.556 0.576 . . . . 85.200000000000003 112.556 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -82.17 165.11 17.09 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 120.996 1.131 . . . . 83.799999999999997 112.558 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . . . -73.05 141.77 47.62 Favored 'General case' 0 C--O 1.234 0.26 0 O-C-N 123.286 0.366 . . . . 89.090000000000003 110.118 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.63 134.33 33.92 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.342 -0.39 . . . . 90.890000000000001 111.846 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . . . -126.37 113.78 17.35 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.813 -0.63 . . . . 86.0 110.741 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -64.45 125.6 25.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.228 -0.442 . . . . 82.099999999999994 110.553 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 4.0 t -128.15 142.54 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.484 -0.78 . . . . 80.849999999999994 110.032 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -86.26 -29.79 22.83 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.927 -0.579 . . . . 84.239999999999995 112.363 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -156.85 132.86 9.64 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.03 -0.73 . . . . 98.040000000000006 109.03 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -60.45 158.34 12.27 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 115.156 1.539 . . . . 101.2 115.156 -171.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -44.36 -54.57 5.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.097 1.147 . . . . 111.65000000000001 114.097 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.399 -0.364 . . . . 107.78 111.316 -179.176 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 777' ' ' DUP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1157 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1158 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . 1.125 ' O ' ' HA ' ' A' ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . 0.767 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . 1.032 ' O ' ' O ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . 0.768 ' O ' ' O ' ' A' ' 94' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . 0.862 ' O ' ' NE2' ' A' ' 40' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . 0.536 ' O ' ' CG1' ' A' ' 67' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . 0.791 ' O ' ' HD2' ' A' ' 79' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . 0.53 ' O ' ' HB3' ' A' ' 81' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2026 ' ' HOH . . . . . 0.447 ' O ' ' HB3' ' A' ' 99' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2029 ' ' HOH . . . . . 1.217 ' O ' ' HA ' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2032 ' ' HOH . . . . . 0.561 ' O ' ' NH2' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2035 ' ' HOH . . . . . 0.803 ' O ' ' HD1' ' A' ' 144' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 1.125 ' HA ' ' O ' ' A' 2001 ' ' HOH . 0.5 OUTLIER . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.414 0.626 . . . . 115.92 109.685 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' N ' ' OG1' ' A' ' 2' ' ' THR . 21.3 t-20 -99.06 34.97 1.99 Allowed 'General case' 0 CA--C 1.482 -1.649 0 N-CA-C 106.038 -1.838 . . . . 111.28 106.038 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.6 p -128.27 148.55 50.65 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.395 -1.275 . . . . 102.52 109.954 174.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.6 tp -110.38 136.32 49.73 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.994 -0.548 . . . . 93.0 110.622 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -85.1 125.87 33.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.837 -0.619 . . . . 94.08 111.351 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.4 t -124.29 133.64 68.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.846 -0.615 . . . . 78.86 109.432 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -124.76 129.25 50.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.364 -0.38 . . . . 77.37 111.182 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt -88.77 134.52 33.9 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.356 -0.609 . . . . 77.65 109.356 174.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.7 mt -102.0 -10.1 20.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.355 0.872 . . . . 75.25 113.355 -174.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.6 p -156.07 178.24 10.51 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.907 0.336 . . . . 75.26 111.907 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.767 ' HG2' ' O ' ' A' 2004 ' ' HOH . 50.4 pttt -73.33 -22.98 60.19 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.036 -0.529 . . . . 76.29 111.596 175.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -81.34 -9.84 59.67 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.551 0.945 . . . . 74.48 113.551 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.57 140.56 34.42 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.416 -0.357 . . . . 73.58 111.582 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -114.29 145.88 41.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.963 -0.562 . . . . 74.24 110.421 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 tpp -70.84 127.22 92.01 Favored Pre-proline 0 C--O 1.234 0.282 0 CA-C-N 115.694 -0.685 . . . . 80.18 110.493 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -54.43 147.23 48.18 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.409 2.073 . . . . 82.37 112.636 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -130.1 129.47 43.59 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 112.658 0.614 . . . . 91.52 112.658 -173.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.0 ttt-85 -117.31 74.98 0.95 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.07 -1.455 . . . . 97.56 107.07 171.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -55.12 -38.64 68.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 115.035 1.494 . . . . 104.98 115.035 -174.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -109.9 143.14 40.23 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 123.28 0.362 . . . . 117.7 111.414 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -74.71 -7.08 52.19 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.04 -0.527 . . . . 107.01 109.792 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -76.55 -35.21 58.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.288 1.035 . . . . 104.97 110.346 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -71.73 148.08 46.74 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 113.277 0.843 . . . . 95.15 113.277 -176.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.49 -26.57 18.74 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.978 0.732 . . . . 83.48 112.978 -177.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -117.58 -176.48 17.32 Favored Glycine 0 C--N 1.331 0.264 0 N-CA-C 115.807 1.083 . . . . 76.89 115.807 -173.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -121.44 125.69 47.49 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.271 0.628 . . . . 81.34 110.07 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -62.1 120.17 10.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.005 -0.543 . . . . 70.67 112.184 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.2 mm -102.98 129.22 55.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.03 -0.532 . . . . 63.59 110.601 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -107.63 143.71 35.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.704 -0.68 . . . . 59.88 111.614 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -72.63 138.85 47.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 62.83 110.822 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.06 7.22 44.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 62.95 110.525 173.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -126.13 157.97 36.71 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.725 -0.67 . . . . 71.46 112.391 -176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.1 m -119.1 111.52 18.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.508 -1.293 . . . . 61.52 107.508 167.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 45' ' ' ILE . 2.0 m -134.65 150.04 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 112.612 0.597 . . . . 61.49 112.612 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.2 t -108.99 120.94 61.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 N-CA-C 108.941 -0.763 . . . . 55.48 108.941 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -103.59 115.89 31.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 52.19 111.847 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.65 162.12 71.72 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.874 -0.603 . . . . 58.37 110.187 174.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.06 136.87 53.74 Favored 'Trans proline' 0 C--N 1.35 0.631 0 O-C-N 122.524 0.749 . . . . 53.43 113.178 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.862 ' NE2' ' O ' ' A' 2009 ' ' HOH . 27.9 mm100 69.66 -2.77 1.85 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.295 1.591 . . . . 56.76 115.295 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -76.44 137.12 39.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.852 0.358 . . . . 69.5 111.912 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -108.64 149.31 29.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.643 -0.708 . . . . 57.33 110.339 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.18 159.01 33.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.424 0.528 . . . . 61.21 112.424 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.0 t -115.22 108.48 25.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 108.05 -1.093 . . . . 58.68 108.05 171.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.423 HD12 HG21 ' A' ' 35' ' ' VAL . 9.6 mm -82.99 123.69 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.985 -0.552 . . . . 64.67 111.222 -175.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -75.2 132.04 40.84 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.016 -0.538 . . . . 75.6 111.065 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 1.032 ' O ' ' O ' ' A' 2007 ' ' HOH . 68.7 p -99.17 -16.74 18.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 66.1 109.991 174.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' H ' HD21 ' A' ' 87' ' ' ASN . 87.8 m-20 54.27 37.74 27.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.058 0.943 . . . . 66.63 112.166 -174.068 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.3 t -128.15 139.7 51.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.349 -0.841 . . . . 67.89 109.266 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.41 137.69 54.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.274 -0.421 . . . . 66.09 110.931 176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -123.76 145.77 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.131 -0.486 . . . . 70.21 111.66 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 t -112.84 80.16 1.32 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.122 0.487 . . . . 71.67 110.635 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.39 126.99 91.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.509 -0.769 . . . . 71.53 109.543 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.52 157.36 59.14 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 121.969 1.779 . . . . 70.7 111.808 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -61.94 148.49 43.48 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.532 0.52 . . . . 66.03 111.115 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.4 4.85 63.92 Favored Glycine 0 C--N 1.33 0.241 0 CA-C-N 115.802 -0.636 . . . . 77.74 111.925 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.38 152.05 51.06 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 122.774 0.429 . . . . 86.62 111.375 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.59 144.38 33.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.909 -0.587 . . . . 72.06 109.535 170.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.04 136.71 12.83 Favored Glycine 0 N--CA 1.458 0.126 0 N-CA-C 110.875 -0.89 . . . . 64.59 110.875 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.5 mt -113.23 98.91 7.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 59.29 110.314 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tt -80.84 93.38 6.25 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.138 -1.43 . . . . 57.45 107.138 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.6 t -119.89 171.45 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 114.246 1.202 . . . . 56.89 114.246 -168.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -77.87 151.7 33.72 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.38 0.881 . . . . 63.21 113.38 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -83.31 149.53 26.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.259 -0.882 . . . . 86.64 108.973 168.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 78.2 p -72.77 -33.34 66.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.205 0.817 . . . . 62.91 113.205 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.09 -43.34 93.54 Favored Glycine 0 N--CA 1.462 0.382 0 CA-C-N 116.399 -0.364 . . . . 56.93 113.674 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.536 ' CG1' ' O ' ' A' 2016 ' ' HOH . 12.3 p -76.06 -38.26 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 112.652 0.612 . . . . 57.23 112.652 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.9 p -75.52 -30.19 59.71 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.682 0.993 . . . . 57.54 113.682 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 93.0 p -81.57 -28.18 33.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.199 0.444 . . . . 54.64 112.199 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -92.51 -36.98 12.76 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.757 1.021 . . . . 58.53 113.757 -175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.2 p -112.32 165.72 11.93 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 111.924 0.342 . . . . 54.29 111.924 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -83.41 9.86 10.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.105 -0.498 . . . . 54.69 112.178 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.79 109.79 5.9 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 122.861 0.464 . . . . 47.89 111.407 177.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.5 t -105.74 118.79 53.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 45.65 109.926 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 97.4 mt -103.63 116.99 48.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.815 -0.629 . . . . 50.76 110.996 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.3 tp10 -78.06 112.01 14.55 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.617 -0.882 . . . . 55.37 108.617 174.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.3 m -51.38 127.41 19.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.703 -0.68 . . . . 54.61 110.852 -177.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' 2021 ' ' HOH . . . -97.6 136.29 12.66 Favored Glycine 0 C--N 1.33 0.222 0 CA-C-N 116.014 -0.539 . . . . 57.03 111.84 178.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HD2' ' O ' ' A' 2021 ' ' HOH . 0.5 OUTLIER -94.74 102.55 14.44 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.888 -0.412 . . . . 58.77 109.888 178.166 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.6 mm -79.66 108.98 13.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 115.974 -0.557 . . . . 66.3 110.107 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.53 ' HB3' ' O ' ' A' 2022 ' ' HOH . 74.9 m-20 -67.4 140.3 57.17 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.621 -0.718 . . . . 76.26 112.675 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.35 96.04 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.568 -0.742 . . . . 77.45 110.777 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 136.94 -18.44 3.56 Favored Glycine 0 N--CA 1.461 0.31 0 CA-C-N 115.908 -0.587 . . . . 77.92 112.888 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -69.18 116.97 10.24 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 122.608 0.363 . . . . 77.79 110.416 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -111.19 14.5 21.76 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.77 0.656 . . . . 86.35 112.77 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.63 -177.48 51.95 Favored Glycine 0 N--CA 1.461 0.333 0 CA-C-N 116.329 -0.396 . . . . 73.68 113.779 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.482 HD21 ' H ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -69.33 124.79 24.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.662 0.385 . . . . 64.68 111.354 179.233 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.476 ' N ' HD22 ' A' ' 87' ' ' ASN . 95.5 mt -70.68 114.4 8.73 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.185 -0.461 . . . . 62.16 110.209 175.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.18 156.52 20.0 Favored Glycine 0 N--CA 1.459 0.175 0 N-CA-C 111.258 -0.737 . . . . 59.55 111.258 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 88.6 mt -112.1 108.31 25.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.327 0.584 . . . . 54.82 110.017 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -75.06 97.28 3.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.006 -0.997 . . . . 56.71 109.947 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 11.0 tt -121.01 154.49 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.816 -0.629 . . . . 50.47 112.671 -170.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.804 ' HE2' ' O ' ' A' 2009 ' ' HOH . 62.1 tttt -148.06 130.05 15.34 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.655 -0.702 . . . . 49.5 109.971 174.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.768 ' O ' ' O ' ' A' 2008 ' ' HOH . 43.1 t-20 -81.27 99.82 8.83 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.415 -0.958 . . . . 52.26 108.415 171.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -83.5 7.05 18.23 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.764 1.024 . . . . 55.31 113.764 -172.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -61.54 142.13 57.28 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.32 -0.992 . . . . 55.62 108.32 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -72.0 151.49 43.17 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 115.4 -2.52 . . . . 59.42 110.681 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -93.86 85.91 4.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.163 -0.926 . . . . 67.2 109.092 -176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' 2026 ' ' HOH . 17.9 p-10 -90.58 14.41 13.29 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.901 1.075 . . . . 80.48 113.901 -174.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.08 -14.85 0.17 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.52 1.674 . . . . 85.83 115.52 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.17 155.25 40.71 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.737 0.643 . . . . 101.92 112.737 177.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -129.48 147.87 51.34 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.826 0.676 . . . . 95.0 112.826 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 9.7 t -134.58 158.93 42.74 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.939 -0.573 . . . . 77.74 111.446 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.3 pt -84.53 -4.87 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 113.892 1.071 . . . . 78.54 113.892 -175.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.85 135.67 23.44 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 114.248 1.203 . . . . 87.23 114.248 176.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.26 171.59 12.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.215 -0.902 . . . . 74.19 109.551 172.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.86 150.41 46.47 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 114.372 1.249 . . . . 74.11 114.372 -176.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -80.43 -175.13 5.0 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.943 1.09 . . . . 61.2 113.943 -175.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.6 pt -75.91 4.59 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 112.951 0.723 . . . . 59.23 112.951 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.0 10.28 26.25 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.266 -0.425 . . . . 69.58 110.316 169.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 65.15 10.29 6.25 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.479 1.288 . . . . 72.12 114.479 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.7 141.95 29.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 78.6 111.196 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -66.96 131.32 45.64 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.912 -0.585 . . . . 83.71 111.776 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 78.9 mt -95.74 111.58 26.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.087 -0.506 . . . . 86.73 110.317 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -79.32 129.61 34.63 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.869 -0.605 . . . . 93.4 111.01 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -114.15 152.29 31.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 95.71 111.84 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . . . -71.64 -38.4 70.72 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.977 -0.556 . . . . 94.45 110.786 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -100.72 134.89 43.01 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.057 -0.52 . . . . 98.25 109.77 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ARG . . . . . 1.217 ' HA ' ' O ' ' A' 2029 ' ' HOH . 0.0 OUTLIER -76.52 136.18 39.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.562 -0.903 . . . . 105.49 108.562 179.474 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -143.37 146.57 33.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.228 -0.896 . . . . 97.28 108.672 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 19.9 mt -99.36 109.08 21.72 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.282 0.475 . . . . 87.13 112.282 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -107.45 157.68 17.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.824 -0.625 . . . . 78.95 109.801 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -74.56 142.28 44.71 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.851 -0.426 . . . . 74.71 109.851 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.21 128.35 35.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.507 -0.315 . . . . 66.34 111.432 -175.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.03 12.34 46.5 Favored Glycine 0 N--CA 1.462 0.417 0 CA-C-N 115.92 -0.582 . . . . 62.74 113.805 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.5 m -79.73 138.69 37.38 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.754 0.312 . . . . 59.96 111.513 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -119.59 150.43 40.3 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.711 -0.677 . . . . 60.77 111.603 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -121.73 129.62 52.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 73.46 110.436 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.1 mt -104.87 132.14 52.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.283 -1.377 . . . . 63.32 107.283 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -109.1 155.41 21.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.07 0.767 . . . . 76.25 113.07 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -57.53 122.47 12.78 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.185 -0.916 . . . . 74.41 111.903 -178.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.46 25.16 31.4 Favored Glycine 0 N--CA 1.461 0.309 0 N-CA-C 114.919 0.727 . . . . 66.41 114.919 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -100.36 143.03 31.03 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.89 1.07 . . . . 67.5 113.89 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.753 ' HG3' HH11 ' A' ' 134' ' ' ARG . 0.0 OUTLIER -73.33 98.88 2.78 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.724 0.81 . . . . 83.59 109.621 175.745 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 34.0 pt -118.4 -20.92 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 113.893 1.072 . . . . 71.19 113.893 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.79 173.09 11.83 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.328 -0.396 . . . . 65.6 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -143.36 150.54 39.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.083 -0.508 . . . . 65.77 111.905 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.93 124.08 50.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 61.8 111.333 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 40.9 t -123.49 121.71 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.199 -0.455 . . . . 58.94 109.922 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 24.6 mt -98.79 127.82 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.834 0.349 . . . . 60.25 110.738 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.0 t -129.12 134.83 26.75 Favored Pre-proline 0 CA--C 1.534 0.337 0 C-N-CA 123.342 0.657 . . . . 64.27 109.624 -174.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.4 148.55 90.12 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.781 2.321 . . . . 68.93 112.793 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.1 pt -133.31 148.99 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.328 0.862 . . . . 75.65 113.328 -178.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' TRP . . . . . 0.803 ' HD1' ' O ' ' A' 2035 ' ' HOH . 21.4 t90 -108.08 114.17 27.87 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.66 -0.7 . . . . 87.36 109.52 176.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.3 p -119.59 78.67 21.4 Favored Pre-proline 0 C--O 1.236 0.38 0 N-CA-C 112.556 0.576 . . . . 85.2 112.556 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -82.17 165.11 17.09 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 120.996 1.131 . . . . 83.8 112.558 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . . . -73.05 141.77 47.62 Favored 'General case' 0 C--O 1.234 0.26 0 O-C-N 123.286 0.366 . . . . 89.09 110.118 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.63 134.33 33.92 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.342 -0.39 . . . . 90.89 111.846 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . . . -126.37 113.78 17.35 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.813 -0.63 . . . . 86.0 110.741 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -64.45 125.6 25.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.228 -0.442 . . . . 82.1 110.553 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 4.0 t -128.15 142.54 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.484 -0.78 . . . . 80.85 110.032 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -86.26 -29.79 22.83 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.927 -0.579 . . . . 84.24 112.363 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -156.85 132.86 9.64 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.03 -0.73 . . . . 98.04 109.03 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -60.45 158.34 12.27 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 115.156 1.539 . . . . 101.2 115.156 -171.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -44.36 -54.57 5.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.097 1.147 . . . . 111.65 114.097 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.399 -0.364 . . . . 107.78 111.316 -179.176 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 777' ' ' DUP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1157 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1158 ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . 1.125 ' O ' ' HA ' ' A' ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . 0.767 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . 1.032 ' O ' ' O ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . 0.768 ' O ' ' O ' ' A' ' 94' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . 0.862 ' O ' ' NE2' ' A' ' 40' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . 0.536 ' O ' ' CG1' ' A' ' 67' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . 0.791 ' O ' ' HD2' ' A' ' 79' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . 0.53 ' O ' ' HB3' ' A' ' 81' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2026 ' ' HOH . . . . . 0.447 ' O ' ' HB3' ' A' ' 99' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2029 ' ' HOH . . . . . 1.217 ' O ' ' HA ' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2032 ' ' HOH . . . . . 0.561 ' O ' ' NH2' ' A' ' 119' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2035 ' ' HOH . . . . . 0.803 ' O ' ' HD1' ' A' ' 144' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_