data_3e0k_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 3e0k _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 ' 298' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.913 0 CA-C-O 121.609 0.718 . . . . 50.43 112.859 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -135.6 127.73 29.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 104.128 -2.545 . . . . 50.539999999999999 104.128 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -108.24 133.9 51.84 Favored 'General case' 0 CA--C 1.509 -0.629 0 C-N-CA 119.008 -1.077 . . . . 45.049999999999997 113.397 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' VAL . . . . . . . . . . . . . 3.9 t -106.66 121.28 59.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.958 -1.127 . . . . 42.600000000000001 107.958 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 -156.68 161.18 39.87 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 118.917 -0.563 . . . . 43.189999999999998 111.997 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -65.88 148.18 52.19 Favored 'General case' 1 CA--C 1.415 -4.246 0 N-CA-C 107.096 -1.446 . . . . 44.299999999999997 107.096 172.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.57 24.38 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.468 1.031 . . . . 45.630000000000003 112.68 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' GLY . . . . . . . . . . . . . . . -125.05 178.51 16.5 Favored Glycine 0 C--O 1.248 0.993 0 CA-C-N 114.686 -1.143 . . . . 47.609999999999999 110.954 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -38.37 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 115.3 -0.45 . . . . 51.229999999999997 112.008 -176.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -65.63 -10.68 38.03 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 114.864 1.431 . . . . 46.950000000000003 114.864 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -87.65 -7.59 57.25 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.714 2.116 . . . . 46.560000000000002 116.714 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' ILE . . . . . . . . . . . . . 33.9 mm -57.13 -54.36 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 118.445 0.566 . . . . 46.240000000000002 111.526 -176.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' GLY . . . . . . . . . . . . . . . -44.13 -52.16 7.1 Favored Glycine 0 CA--C 1.524 0.598 0 O-C-N 122.981 0.176 . . . . 44.560000000000002 113.211 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' GLY . . . . . . . . . . . . . . . -64.3 -36.06 92.73 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 114.733 0.653 . . . . 43.18 114.733 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' ILE . . . . . . . . . . . . . 67.2 mt -66.92 -43.18 89.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-N 117.924 0.862 . . . . 42.32 109.517 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' LEU . . . . . . . . . . . . . 63.8 mt -58.17 -37.25 74.34 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.581 -0.736 . . . . 42.780000000000001 112.076 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -68.67 -34.48 75.76 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.82 -0.627 . . . . 45.219999999999999 109.652 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 14.4 mt -72.77 -37.55 67.59 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.747 -0.781 . . . . 45.299999999999997 110.217 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' ILE . . . . . . . . . . . . . 40.2 mt -81.14 -40.91 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 115.291 -0.868 . . . . 53.850000000000001 111.272 -171.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -50.14 -48.24 79.97 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.07 1.508 . . . . 58.609999999999999 115.07 -173.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -63.29 -22.19 72.08 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 N-CA-C 114.113 0.774 . . . . 54.719999999999999 114.113 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.88 -36.62 59.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.686 0.254 . . . . 59.299999999999997 111.686 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -65.48 -44.08 88.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.865 0.866 . . . . 59.93 113.236 176.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -59.22 -37.09 76.64 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.715 0.806 . . . . 63.450000000000003 111.288 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -78.41 2.11 19.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.007 1.114 . . . . 64.049999999999997 114.007 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' GLY . . . . . . . . . . . . . . . 82.18 2.96 90.7 Favored Glycine 0 N--CA 1.473 1.108 0 N-CA-C 114.99 0.756 . . . . 63.909999999999997 114.99 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' ILE . . . . . . . . . . . . . 61.3 mt -74.39 -50.41 27.24 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.051 1.13 . . . . 65.060000000000002 114.051 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.566 0 N-CA-C 112.855 0.687 . . . . 65.140000000000001 112.855 -174.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.58 0.956 . . . . 66.609999999999999 113.58 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -100.89 111.8 24.1 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.836 1.05 . . . . 59.890000000000001 113.836 -178.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' SER . . . . . . . . . . . . . 67.3 p -66.28 161.69 21.73 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 123.436 0.46 . . . . 57.670000000000002 112.14 165.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.6 ttm105 -58.8 -45.8 89.06 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 121.098 -0.241 . . . . 54.829999999999998 111.233 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.33 -41.73 89.81 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 110.435 -0.209 . . . . 55.909999999999997 110.435 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.21 -44.59 95.01 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 120.615 0.245 . . . . 57.630000000000003 111.465 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' LEU . . . . . . . . . . . . . 4.4 tp -65.58 -38.68 90.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.238 -0.585 . . . . 49.380000000000003 111.717 176.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -57.83 -36.9 72.9 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.943 -0.473 . . . . 50.960000000000001 111.588 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -76.35 -21.53 56.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.728 1.011 . . . . 45.560000000000002 113.728 -175.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' GLU . . . . . 0.622 ' OE2' ' OH ' ' A' ' 356' ' ' TYR 0.332 23.3 mt-10 -114.84 -0.7 13.4 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.985 0.914 . . . . 50.359999999999999 111.743 -172.835 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' ILE . . . . . . . . . . . . . 10.1 tp -46.95 -38.62 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 114.503 1.297 . . . . 43.409999999999997 114.503 -171.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' GLY . . . . . . . . . . . . . . . -54.79 -21.66 23.54 Favored Glycine 0 C--O 1.22 -0.738 0 N-CA-C 114.68 0.632 . . . . 42.049999999999997 114.68 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -86.93 -14.29 42.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.492 0.646 . . . . 44.520000000000003 110.818 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -94.45 140.39 29.88 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 114.915 1.45 . . . . 38.369999999999997 114.915 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' THR . . . . . . . . . . . . . 87.0 m -113.73 143.81 44.0 Favored 'General case' 0 C--O 1.252 1.218 0 N-CA-C 106.582 -1.636 . . . . 38.020000000000003 106.582 168.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.08 167.68 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 N-CA-C 114.924 1.453 . . . . 40.520000000000003 114.924 169.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' ILE . . . . . . . . . . . . . 15.4 mt -113.54 127.78 70.72 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 124.311 1.044 . . . . 35.920000000000002 108.956 165.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -114.8 129.13 56.64 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.72 1.608 . . . . 36.210000000000001 106.861 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -130.34 122.05 27.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 105.803 -1.925 . . . . 48.049999999999997 105.803 174.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 50.11 32.2 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.485 1.291 . . . . 43.210000000000001 114.485 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.17 76.64 Favored Glycine 0 C--N 1.332 0.324 0 CA-C-O 119.209 -0.773 . . . . 37.090000000000003 113.439 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 32.0 tp -108.39 132.64 53.55 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.732 -0.84 . . . . 36.469999999999999 108.732 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' ILE . . . . . . . . . . . . . 27.8 mt -79.41 113.36 18.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.88 0 N-CA-C 108.352 -0.981 . . . . 38.859999999999999 108.352 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' ILE . . . . . . . . . . . . . 12.1 pt -114.41 3.51 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 O-C-N 123.872 0.733 . . . . 35.909999999999997 112.82 -172.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' GLY . . . . . . . . . . . . . . . -167.18 151.61 19.6 Favored Glycine 0 C--O 1.226 -0.352 0 N-CA-C 110.667 -0.973 . . . . 36.240000000000002 110.667 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.0 166.57 29.26 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.336 -0.616 . . . . 40.090000000000003 109.336 170.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -166.89 147.57 5.8 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 105.02 -2.215 . . . . 38.780000000000001 105.02 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' ALA . . . . . . . . . . . . . . . -116.15 148.44 40.33 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.009 0.818 . . . . 38.229999999999997 108.967 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' LEU . . . . . . . . . . . . . 19.5 tp -127.67 122.27 32.58 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.224 -0.658 . . . . 38.990000000000002 109.224 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' TYR . . . . . 0.622 ' OH ' ' OE2' ' A' ' 336' ' ' GLU . 92.4 m-85 -111.35 101.48 50.7 Favored Pre-proline 0 CA--C 1.513 -0.464 0 O-C-N 123.462 0.476 . . . . 39.399999999999999 110.574 -179.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.05 141.49 32.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 O-C-N 123.466 1.245 . . . . 40.299999999999997 112.67 -174.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -117.09 91.61 3.63 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 106.159 -1.793 . . . . 42.359999999999999 106.159 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 7.8 t -62.37 -53.23 57.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 114.219 1.192 . . . . 46.210000000000001 114.219 -161.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -68.14 -23.75 64.92 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.826 1.25 . . . . 56.43 113.059 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 58.0 mp0 -93.55 -7.28 44.63 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.377 -0.971 . . . . 47.68 108.377 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 56.96 38.06 29.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.324 0.583 . . . . 45.799999999999997 111.276 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' LYS . . . . . 0.522 ' NZ ' ' O ' ' A' ' 39' ' ' HOH . 83.4 mttt -127.16 159.33 34.57 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.759 -1.571 . . . . 40.07 106.759 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -147.16 138.93 24.24 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.481 0.657 . . . . 39.609999999999999 110.573 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -91.72 128.11 37.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.899 -1.046 . . . . 43.990000000000002 110.144 176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' MSE . . . . . . . . . . . . . 2.6 ttm -91.51 118.38 30.53 Favored 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 107.37 -1.345 . . . . 38.420000000000002 107.37 168.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -131.83 172.15 12.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.183 -0.917 . . . . 39.479999999999997 110.445 -178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' CYS . . . . . . . . . . . . . 9.6 t 58.46 44.51 17.95 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 114.819 -1.082 . . . . 43.770000000000003 110.407 167.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.57 116.29 30.05 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 C-N-CA 124.801 1.241 . . . . 39.170000000000002 109.42 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -135.05 135.41 41.27 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.913 -0.315 . . . . 38.450000000000003 110.721 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' ILE . . . . . . . . . . . . . 39.5 mm -116.16 133.08 63.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.275 -1.009 . . . . 38.0 108.275 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -50.61 135.05 26.09 Favored Pre-proline 0 N--CA 1.446 -0.654 0 N-CA-C 109.137 -0.69 . . . . 38.380000000000003 109.137 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.67 -33.45 93.59 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 N-CA-C 115.266 1.218 . . . . 37.869999999999997 115.266 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -80.1 0.5 31.77 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.537 1.31 . . . . 39.539999999999999 114.537 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -125.99 22.71 7.3 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 114.173 1.175 . . . . 39.5 114.173 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' ARG . . . . . . . . . . . . . 7.9 mmm-85 -76.54 178.74 6.42 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.858 -0.423 . . . . 46.409999999999997 109.858 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 44.72 43.3 6.64 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.878 0.696 . . . . 48.799999999999997 112.878 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -133.13 23.99 3.83 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 109.638 -1.385 . . . . 45.850000000000001 109.638 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 26.9 m120 58.79 27.05 15.51 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.24 0.83 . . . . 47.229999999999997 113.24 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -77.04 -32.48 57.0 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 119.788 -0.765 . . . . 43.409999999999997 112.26 -174.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' GLY . . . . . . . . . . . . . . . -57.33 -46.32 91.91 Favored Glycine 0 C--O 1.242 0.609 0 C-N-CA 120.782 -0.723 . . . . 41.299999999999997 112.001 170.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.51 -43.58 96.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.432 0.634 . . . . 40.07 111.233 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 9.3 tp -51.0 -55.29 18.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.469 -0.787 . . . . 40.170000000000002 110.64 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 29.1 mt -58.1 -43.29 87.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.147 0.795 . . . . 38.189999999999998 113.147 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.64 -47.82 82.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 119.938 -0.705 . . . . 38.020000000000003 110.695 -177.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -63.35 -33.81 76.35 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 112.258 0.466 . . . . 42.880000000000003 112.258 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -67.91 -41.09 83.18 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 123.997 0.81 . . . . 41.390000000000001 109.105 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' MSE . . . . . . . . . . . . . 5.2 mmt -65.48 -49.25 69.77 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.199 -0.455 . . . . 48.509999999999998 110.233 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -48.75 -55.53 11.21 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.574 -0.528 . . . . 43.950000000000003 109.574 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' HIS . . . . . . . . . . . . . 39.9 t-80 -59.83 -39.1 83.96 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.611 0.967 . . . . 47.82 113.611 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -69.84 -45.09 68.58 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 123.592 0.557 . . . . 53.030000000000001 112.125 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' SER . . . . . . . . . . . . . 57.1 m -59.46 -45.47 91.53 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.388 0.43 . . . . 46.899999999999999 111.642 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' LYS . . . . . . . . . . . . . 18.2 mtmt -53.01 -44.7 67.5 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 124.246 0.966 . . . . 51.920000000000002 110.256 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 4.5 p -74.8 -3.04 29.38 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.656 1.354 . . . . 48.560000000000002 114.656 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -111.68 21.5 16.02 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.808 -0.558 . . . . 53.549999999999997 112.458 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' ASN . . . . . . . . . . . . . 55.0 t30 70.75 22.62 4.79 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.364 1.066 . . . . 45.600000000000001 113.56 176.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' ILE . . . . . . . . . . . . . 13.5 mt -101.34 132.61 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.543 1.137 . . . . 43.340000000000003 110.447 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -117.87 4.22 12.19 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 114.657 1.354 . . . . 45.0 114.657 -172.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -144.65 139.83 28.27 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 113.582 0.956 . . . . 44.939999999999998 113.582 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' ILE . . . . . . . . . . . . . 8.2 mt -111.11 140.28 31.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 108.217 -1.031 . . . . 39.479999999999997 108.217 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -130.88 153.67 48.89 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 120.596 -0.442 . . . . 39.939999999999998 111.125 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.76 153.23 38.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.193 -1.04 . . . . 42.119999999999997 108.193 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.39 115.33 28.55 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 105.111 -2.181 . . . . 50.509999999999998 105.111 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' THR . . . . . . . . . . . . . 11.6 t -142.53 155.3 45.01 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.033 -0.667 . . . . 49.590000000000003 111.333 -168.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 55.0 p -121.53 -4.22 9.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.622 -1.251 . . . . 52.25 107.622 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -120.72 149.45 42.5 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.723 1.209 . . . . 56.189999999999998 109.354 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' SER . . . . . . . . . . . . . 19.0 m 68.29 39.2 2.34 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.338 1.977 . . . . 57.079999999999998 116.338 165.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.25 -44.31 88.24 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.01 1.485 . . . . 58.350000000000001 115.01 177.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -55.07 -46.78 75.44 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 122.896 0.123 . . . . 52.990000000000002 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -63.91 -46.33 85.3 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.906 0.706 . . . . 50.840000000000003 112.906 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.9 -48.3 81.07 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.825 -0.625 . . . . 49.039999999999999 111.633 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' ARG . . . . . . . . . . . . . 19.6 ttm105 -55.31 -44.31 75.66 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.076 0.465 . . . . 61.270000000000003 110.093 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.12 -24.82 60.17 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 113.465 0.913 . . . . 54.520000000000003 113.465 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -90.8 -3.52 57.35 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.724 1.009 . . . . 46.109999999999999 113.724 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . 101.22 9.81 43.75 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 112.014 -0.434 . . . . 40.359999999999999 112.014 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.58 142.33 55.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 122.381 0.272 . . . . 38.009999999999998 110.334 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -129.64 156.08 44.81 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.214 -0.661 . . . . 38.450000000000003 109.214 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -84.38 137.22 33.52 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 120.12 -0.632 . . . . 35.079999999999998 110.566 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.04 164.32 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.518 -0.764 . . . . 35.609999999999999 110.234 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' GLY . . . . . . . . . . . . . . . -86.84 170.35 41.69 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-O 119.524 -0.598 . . . . 36.299999999999997 113.296 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 1.9 m -61.31 -27.91 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 113.324 0.861 . . . . 38.009999999999998 113.324 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -60.23 -21.65 62.07 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 114.29 1.218 . . . . 41.289999999999999 114.29 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -71.09 -31.37 67.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 110.207 -0.294 . . . . 40.490000000000002 110.207 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.6 137.75 61.93 Favored Pre-proline 0 C--O 1.245 0.834 0 N-CA-C 114.163 1.172 . . . . 39.93 114.163 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.28 133.88 52.17 Favored 'Trans proline' 0 C--O 1.239 0.54 0 N-CA-C 108.782 -1.276 . . . . 41.960000000000001 108.782 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -36.96 -36.52 0.18 Allowed Glycine 0 N--CA 1.477 1.406 0 N-CA-C 117.368 1.707 . . . . 42.600000000000001 117.368 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.98 94.71 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.828 -0.749 . . . . 47.170000000000002 109.506 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.57 -0.58 55.44 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 114.706 -1.134 . . . . 50.479999999999997 111.365 -173.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.17 -46.71 22.48 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.579 1.326 . . . . 53.549999999999997 114.579 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -46.07 -26.81 2.28 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 115.133 0.813 . . . . 53.509999999999998 115.133 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . . . -95.02 -39.29 10.24 Favored 'General case' 0 C--O 1.248 0.996 0 N-CA-C 116.132 1.901 . . . . 53.780000000000001 116.132 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . . . -58.84 -38.45 78.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.55 0.34 . . . . 53.399999999999999 110.32 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . . . -90.82 33.95 0.92 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.834 -0.621 . . . . 52.25 111.75 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' PHE . . . . . . . . . . . . . 22.6 t80 . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 114.044 1.127 . . . . 51.450000000000003 114.044 178.086 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 112.829 0.678 . . . . 67.200000000000003 112.829 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . . . -73.99 38.0 0.1 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 120.997 0.427 . . . . 61.789999999999999 112.011 170.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' SER . . . . . . . . . . . . . 31.1 t -107.38 112.76 25.72 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.748 1.018 . . . . 57.219999999999999 113.748 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -100.77 148.51 24.83 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.376 -0.827 . . . . 50.689999999999998 112.755 -170.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' ILE . . . . . . . . . . . . . 21.0 mt -102.47 121.66 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 108.012 -1.107 . . . . 43.5 108.012 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 53.4 mt -119.05 136.12 54.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.731 -0.388 . . . . 39.009999999999998 111.76 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -117.18 151.85 36.0 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.384 0.883 . . . . 35.810000000000002 113.384 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' LEU . . . . . . . . . . . . . 38.5 tp -132.3 123.18 26.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 38.359999999999999 109.338 -178.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -76.31 120.57 21.75 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.417 0.627 . . . . 44.729999999999997 110.969 174.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 CA--C 1.514 -0.409 0 N-CA-C 108.773 -0.825 . . . . 39.93 108.773 -178.357 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . 0.522 ' O ' ' NZ ' ' A' ' 363' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 298' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.913 0 CA-C-O 121.609 0.718 . . . . 50.43 112.859 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -135.6 127.73 29.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 104.128 -2.545 . . . . 50.54 104.128 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -108.24 133.9 51.84 Favored 'General case' 0 CA--C 1.509 -0.629 0 C-N-CA 119.008 -1.077 . . . . 45.05 113.397 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' VAL . . . . . . . . . . . . . 3.9 t -106.66 121.28 59.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.958 -1.127 . . . . 42.6 107.958 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' ARG . . . . . 0.586 ' NH1' HD11 ' A' ' 342' ' ' ILE . 38.3 ptt85 -156.68 161.18 39.87 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 118.917 -0.563 . . . . 43.19 111.997 -173.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -65.88 148.18 52.19 Favored 'General case' 1 CA--C 1.415 -4.246 0 N-CA-C 107.096 -1.446 . . . . 44.3 107.096 172.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 304' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.57 24.38 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.468 1.031 . . . . 45.63 112.68 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' GLY . . . . . . . . . . . . . . . -125.05 178.51 16.5 Favored Glycine 0 C--O 1.248 0.993 0 CA-C-N 114.686 -1.143 . . . . 47.61 110.954 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' ILE . . . . . 0.494 ' O ' HG12 ' A' ' 309' ' ' ILE . 0.1 OUTLIER -63.35 -38.37 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 115.3 -0.45 . . . . 51.23 112.008 -176.184 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -65.63 -10.68 38.03 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 114.864 1.431 . . . . 46.95 114.864 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 308' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -87.65 -7.59 57.25 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.714 2.116 . . . . 46.56 116.714 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' ILE . . . . . 0.532 HG23 HD23 ' A' ' 333' ' ' LEU . 33.9 mm -57.13 -54.36 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 118.445 0.566 . . . . 46.24 111.526 -176.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 310' ' ' GLY . . . . . . . . . . . . . . . -44.13 -52.16 7.1 Favored Glycine 0 CA--C 1.524 0.598 0 O-C-N 122.981 0.176 . . . . 44.56 113.211 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 311' ' ' GLY . . . . . . . . . . . . . . . -64.3 -36.06 92.73 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 114.733 0.653 . . . . 43.18 114.733 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 312' ' ' ILE . . . . . 0.541 HG22 HD12 ' A' ' 316' ' ' ILE . 67.2 mt -66.92 -43.18 89.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-N 117.924 0.862 . . . . 42.32 109.517 176.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 313' ' ' LEU . . . . . . . . . . . . . 63.8 mt -58.17 -37.25 74.34 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.581 -0.736 . . . . 42.78 112.076 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 314' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -68.67 -34.48 75.76 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.82 -0.627 . . . . 45.22 109.652 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 14.4 mt -72.77 -37.55 67.59 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.747 -0.781 . . . . 45.3 110.217 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 316' ' ' ILE . . . . . 0.541 HD12 HG22 ' A' ' 312' ' ' ILE . 40.2 mt -81.14 -40.91 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 115.291 -0.868 . . . . 53.85 111.272 -171.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -50.14 -48.24 79.97 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.07 1.508 . . . . 58.61 115.07 -173.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 318' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -63.29 -22.19 72.08 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 N-CA-C 114.113 0.774 . . . . 54.72 114.113 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.88 -36.62 59.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.686 0.254 . . . . 59.3 111.686 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 320' ' ' GLU . . . . . 0.422 ' CD ' ' HB2' ' A' ' 327' ' ' ARG . 98.8 mt-10 -65.48 -44.08 88.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.865 0.866 . . . . 59.93 113.236 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 321' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -59.22 -37.09 76.64 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.715 0.806 . . . . 63.45 111.288 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 322' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -78.41 2.11 19.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.007 1.114 . . . . 64.05 114.007 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 323' ' ' GLY . . . . . . . . . . . . . . . 82.18 2.96 90.7 Favored Glycine 0 N--CA 1.473 1.108 0 N-CA-C 114.99 0.756 . . . . 63.91 114.99 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 324' ' ' ILE . . . . . . . . . . . . . 61.3 mt -74.39 -50.41 27.24 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.051 1.13 . . . . 65.06 114.051 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 325' ' ' LEU . . . . . 0.406 HD23 HG23 ' A' ' 316' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.566 0 N-CA-C 112.855 0.687 . . . . 65.14 112.855 -174.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 327' ' ' ARG . . . . . 0.422 ' HB2' ' CD ' ' A' ' 320' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.58 0.956 . . . . 66.61 113.58 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -100.89 111.8 24.1 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.836 1.05 . . . . 59.89 113.836 -178.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 329' ' ' SER . . . . . . . . . . . . . 67.3 p -66.28 161.69 21.73 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 123.436 0.46 . . . . 57.67 112.14 165.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.6 ttm105 -58.8 -45.8 89.06 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 121.098 -0.241 . . . . 54.83 111.233 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 331' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.33 -41.73 89.81 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 110.435 -0.209 . . . . 55.91 110.435 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 332' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.21 -44.59 95.01 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 120.615 0.245 . . . . 57.63 111.465 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 333' ' ' LEU . . . . . 0.532 HD23 HG23 ' A' ' 309' ' ' ILE . 4.4 tp -65.58 -38.68 90.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.238 -0.585 . . . . 49.38 111.717 176.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 334' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -57.83 -36.9 72.9 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.943 -0.473 . . . . 50.96 111.588 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 335' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -76.35 -21.53 56.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.728 1.011 . . . . 45.56 113.728 -175.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 336' ' ' GLU . . . . . 0.484 ' OE2' ' OH ' ' A' ' 356' ' ' TYR 0.332 23.3 mt-10 -114.84 -0.7 13.4 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.985 0.914 . . . . 50.36 111.743 -172.835 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 337' ' ' ILE . . . . . 0.467 HD13 ' CD1' ' A' ' 309' ' ' ILE . 10.1 tp -46.95 -38.62 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 114.503 1.297 . . . . 43.41 114.503 -171.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 338' ' ' GLY . . . . . . . . . . . . . . . -54.79 -21.66 23.54 Favored Glycine 0 C--O 1.22 -0.738 0 N-CA-C 114.68 0.632 . . . . 42.05 114.68 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -86.93 -14.29 42.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.492 0.646 . . . . 44.52 110.818 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 340' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -94.45 140.39 29.88 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 114.915 1.45 . . . . 38.37 114.915 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 341' ' ' THR . . . . . . . . . . . . . 87.0 m -113.73 143.81 44.0 Favored 'General case' 0 C--O 1.252 1.218 0 N-CA-C 106.582 -1.636 . . . . 38.02 106.582 168.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 342' ' ' ILE . . . . . 0.586 HD11 ' NH1' ' A' ' 302' ' ' ARG . 0.2 OUTLIER -126.08 167.68 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 N-CA-C 114.924 1.453 . . . . 40.52 114.924 169.941 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 343' ' ' ILE . . . . . . . . . . . . . 15.4 mt -113.54 127.78 70.72 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 124.311 1.044 . . . . 35.92 108.956 165.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 344' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -114.8 129.13 56.64 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.72 1.608 . . . . 36.21 106.861 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 345' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -130.34 122.05 27.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 105.803 -1.925 . . . . 48.05 105.803 174.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 346' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 50.11 32.2 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.485 1.291 . . . . 43.21 114.485 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.17 76.64 Favored Glycine 0 C--N 1.332 0.324 0 CA-C-O 119.209 -0.773 . . . . 37.09 113.439 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 32.0 tp -108.39 132.64 53.55 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.732 -0.84 . . . . 36.47 108.732 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 349' ' ' ILE . . . . . . . . . . . . . 27.8 mt -79.41 113.36 18.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.88 0 N-CA-C 108.352 -0.981 . . . . 38.86 108.352 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 350' ' ' ILE . . . . . . . . . . . . . 12.1 pt -114.41 3.51 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 O-C-N 123.872 0.733 . . . . 35.91 112.82 -172.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 351' ' ' GLY . . . . . . . . . . . . . . . -167.18 151.61 19.6 Favored Glycine 0 C--O 1.226 -0.352 0 N-CA-C 110.667 -0.973 . . . . 36.24 110.667 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 352' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.0 166.57 29.26 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.336 -0.616 . . . . 40.09 109.336 170.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -166.89 147.57 5.8 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 105.02 -2.215 . . . . 38.78 105.02 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 354' ' ' ALA . . . . . . . . . . . . . . . -116.15 148.44 40.33 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.009 0.818 . . . . 38.23 108.967 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 355' ' ' LEU . . . . . . . . . . . . . 19.5 tp -127.67 122.27 32.58 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.224 -0.658 . . . . 38.99 109.224 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 356' ' ' TYR . . . . . 0.484 ' OH ' ' OE2' ' A' ' 336' ' ' GLU . 92.4 m-85 -111.35 101.48 50.7 Favored Pre-proline 0 CA--C 1.513 -0.464 0 O-C-N 123.462 0.476 . . . . 39.4 110.574 -179.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 357' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.05 141.49 32.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 O-C-N 123.466 1.245 . . . . 40.3 112.67 -174.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 358' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -117.09 91.61 3.63 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 106.159 -1.793 . . . . 42.36 106.159 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 7.8 t -62.37 -53.23 57.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 114.219 1.192 . . . . 46.21 114.219 -161.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -68.14 -23.75 64.92 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.826 1.25 . . . . 56.43 113.059 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 58.0 mp0 -93.55 -7.28 44.63 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.377 -0.971 . . . . 47.68 108.377 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 56.96 38.06 29.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.324 0.583 . . . . 45.8 111.276 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -127.16 159.33 34.57 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.759 -1.571 . . . . 40.07 106.759 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -147.16 138.93 24.24 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.481 0.657 . . . . 39.61 110.573 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 365' ' ' GLU . . . . . 0.629 ' OE1' ' HE2' ' A' ' 428' ' ' LYS . 88.8 tt0 -91.72 128.11 37.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.899 -1.046 . . . . 43.99 110.144 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 366' ' ' MSE . . . . . 0.561 ' HE1' ' CD1' ' A' ' 385' ' ' LEU . 2.6 ttm -91.51 118.38 30.53 Favored 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 107.37 -1.345 . . . . 38.42 107.37 168.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -131.83 172.15 12.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.183 -0.917 . . . . 39.48 110.445 -178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 368' ' ' CYS . . . . . . . . . . . . . 9.6 t 58.46 44.51 17.95 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 114.819 -1.082 . . . . 43.77 110.407 167.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.57 116.29 30.05 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 C-N-CA 124.801 1.241 . . . . 39.17 109.42 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -135.05 135.41 41.27 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.913 -0.315 . . . . 38.45 110.721 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' ILE . . . . . . . . . . . . . 39.5 mm -116.16 133.08 63.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.275 -1.009 . . . . 38.0 108.275 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 372' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -50.61 135.05 26.09 Favored Pre-proline 0 N--CA 1.446 -0.654 0 N-CA-C 109.137 -0.69 . . . . 38.38 109.137 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.67 -33.45 93.59 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 N-CA-C 115.266 1.218 . . . . 37.87 115.266 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 374' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -80.1 0.5 31.77 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.537 1.31 . . . . 39.54 114.537 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -125.99 22.71 7.3 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 114.173 1.175 . . . . 39.5 114.173 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 376' ' ' ARG . . . . . . . . . . . . . 7.9 mmm-85 -76.54 178.74 6.42 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.858 -0.423 . . . . 46.41 109.858 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 44.72 43.3 6.64 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.878 0.696 . . . . 48.8 112.878 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -133.13 23.99 3.83 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 109.638 -1.385 . . . . 45.85 109.638 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 26.9 m120 58.79 27.05 15.51 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.24 0.83 . . . . 47.23 113.24 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -77.04 -32.48 57.0 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 119.788 -0.765 . . . . 43.41 112.26 -174.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 381' ' ' GLY . . . . . . . . . . . . . . . -57.33 -46.32 91.91 Favored Glycine 0 C--O 1.242 0.609 0 C-N-CA 120.782 -0.723 . . . . 41.3 112.001 170.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.51 -43.58 96.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.432 0.634 . . . . 40.07 111.233 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 9.3 tp -51.0 -55.29 18.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.469 -0.787 . . . . 40.17 110.64 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 29.1 mt -58.1 -43.29 87.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.147 0.795 . . . . 38.19 113.147 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 385' ' ' LEU . . . . . 0.561 ' CD1' ' HE1' ' A' ' 366' ' ' MSE . 24.7 tp -62.64 -47.82 82.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 119.938 -0.705 . . . . 38.02 110.695 -177.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 386' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.35 -33.81 76.35 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 112.258 0.466 . . . . 42.88 112.258 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -67.91 -41.09 83.18 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 123.997 0.81 . . . . 41.39 109.105 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 388' ' ' MSE . . . . . 0.468 ' HG3' 'SE ' ' A' ' 366' ' ' MSE . 5.2 mmt -65.48 -49.25 69.77 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.199 -0.455 . . . . 48.51 110.233 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 389' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -48.75 -55.53 11.21 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.574 -0.528 . . . . 43.95 109.574 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 390' ' ' HIS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 393' ' ' LYS . 39.9 t-80 -59.83 -39.1 83.96 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.611 0.967 . . . . 47.82 113.611 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -69.84 -45.09 68.58 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 123.592 0.557 . . . . 53.03 112.125 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 392' ' ' SER . . . . . . . . . . . . . 57.1 m -59.46 -45.47 91.53 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.388 0.43 . . . . 46.9 111.642 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 393' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 390' ' ' HIS . 18.2 mtmt -53.01 -44.7 67.5 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 124.246 0.966 . . . . 51.92 110.256 179.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 4.5 p -74.8 -3.04 29.38 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.656 1.354 . . . . 48.56 114.656 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -111.68 21.5 16.02 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.808 -0.558 . . . . 53.55 112.458 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 396' ' ' ASN . . . . . . . . . . . . . 55.0 t30 70.75 22.62 4.79 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.364 1.066 . . . . 45.6 113.56 176.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' ILE . . . . . . . . . . . . . 13.5 mt -101.34 132.61 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.543 1.137 . . . . 43.34 110.447 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -117.87 4.22 12.19 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 114.657 1.354 . . . . 45.0 114.657 -172.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 399' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -144.65 139.83 28.27 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 113.582 0.956 . . . . 44.94 113.582 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' ILE . . . . . . . . . . . . . 8.2 mt -111.11 140.28 31.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 108.217 -1.031 . . . . 39.48 108.217 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' PHE . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 365' ' ' GLU . 50.2 p90 -130.88 153.67 48.89 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 120.596 -0.442 . . . . 39.94 111.125 172.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.76 153.23 38.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.193 -1.04 . . . . 42.12 108.193 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.39 115.33 28.55 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 105.111 -2.181 . . . . 50.51 105.111 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 404' ' ' THR . . . . . . . . . . . . . 11.6 t -142.53 155.3 45.01 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.033 -0.667 . . . . 49.59 111.333 -168.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 55.0 p -121.53 -4.22 9.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.622 -1.251 . . . . 52.25 107.622 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -120.72 149.45 42.5 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.723 1.209 . . . . 56.19 109.354 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 407' ' ' SER . . . . . . . . . . . . . 19.0 m 68.29 39.2 2.34 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.338 1.977 . . . . 57.08 116.338 165.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 408' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.25 -44.31 88.24 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.01 1.485 . . . . 58.35 115.01 177.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -55.07 -46.78 75.44 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 122.896 0.123 . . . . 52.99 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 410' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -63.91 -46.33 85.3 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.906 0.706 . . . . 50.84 112.906 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.9 -48.3 81.07 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.825 -0.625 . . . . 49.04 111.633 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 412' ' ' ARG . . . . . . . . . . . . . 19.6 ttm105 -55.31 -44.31 75.66 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.076 0.465 . . . . 61.27 110.093 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.12 -24.82 60.17 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 113.465 0.913 . . . . 54.52 113.465 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -90.8 -3.52 57.35 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.724 1.009 . . . . 46.11 113.724 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . 101.22 9.81 43.75 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 112.014 -0.434 . . . . 40.36 112.014 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 416' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.58 142.33 55.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 122.381 0.272 . . . . 38.01 110.334 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -129.64 156.08 44.81 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.214 -0.661 . . . . 38.45 109.214 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -84.38 137.22 33.52 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 120.12 -0.632 . . . . 35.08 110.566 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 419' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.04 164.32 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.518 -0.764 . . . . 35.61 110.234 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 420' ' ' GLY . . . . . . . . . . . . . . . -86.84 170.35 41.69 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-O 119.524 -0.598 . . . . 36.3 113.296 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 1.9 m -61.31 -27.91 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 113.324 0.861 . . . . 38.01 113.324 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -60.23 -21.65 62.07 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 114.29 1.218 . . . . 41.29 114.29 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -71.09 -31.37 67.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 110.207 -0.294 . . . . 40.49 110.207 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.6 137.75 61.93 Favored Pre-proline 0 C--O 1.245 0.834 0 N-CA-C 114.163 1.172 . . . . 39.93 114.163 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.28 133.88 52.17 Favored 'Trans proline' 0 C--O 1.239 0.54 0 N-CA-C 108.782 -1.276 . . . . 41.96 108.782 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -36.96 -36.52 0.18 Allowed Glycine 0 N--CA 1.477 1.406 0 N-CA-C 117.368 1.707 . . . . 42.6 117.368 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.98 94.71 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.828 -0.749 . . . . 47.17 109.506 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' LYS . . . . . 0.629 ' HE2' ' OE1' ' A' ' 365' ' ' GLU . 0.6 OUTLIER -85.57 -0.58 55.44 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 114.706 -1.134 . . . . 50.48 111.365 -173.805 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.17 -46.71 22.48 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.579 1.326 . . . . 53.55 114.579 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -46.07 -26.81 2.28 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 115.133 0.813 . . . . 53.51 115.133 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . . . -95.02 -39.29 10.24 Favored 'General case' 0 C--O 1.248 0.996 0 N-CA-C 116.132 1.901 . . . . 53.78 116.132 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . . . -58.84 -38.45 78.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.55 0.34 . . . . 53.4 110.32 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . . . -90.82 33.95 0.92 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.834 -0.621 . . . . 52.25 111.75 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' PHE . . . . . . . . . . . . . 22.6 t80 . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 114.044 1.127 . . . . 51.45 114.044 178.086 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' ARG . . . . . 0.493 ' HG3' ' H ' ' A' ' 437' ' ' LYS . 6.1 ptm180 . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 112.829 0.678 . . . . 67.2 112.829 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' LYS . . . . . 0.493 ' H ' ' HG3' ' A' ' 436' ' ' ARG . . . -73.99 38.0 0.1 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 120.997 0.427 . . . . 61.79 112.011 170.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 438' ' ' SER . . . . . . . . . . . . . 31.1 t -107.38 112.76 25.72 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.748 1.018 . . . . 57.22 113.748 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -100.77 148.51 24.83 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.376 -0.827 . . . . 50.69 112.755 -170.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' ILE . . . . . . . . . . . . . 21.0 mt -102.47 121.66 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 108.012 -1.107 . . . . 43.5 108.012 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 53.4 mt -119.05 136.12 54.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.731 -0.388 . . . . 39.01 111.76 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -117.18 151.85 36.0 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.384 0.883 . . . . 35.81 113.384 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' LEU . . . . . . . . . . . . . 38.5 tp -132.3 123.18 26.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 38.36 109.338 -178.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 444' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -76.31 120.57 21.75 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.417 0.627 . . . . 44.73 110.969 174.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 CA--C 1.514 -0.409 0 N-CA-C 108.773 -0.825 . . . . 39.93 108.773 -178.357 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . 0.406 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.913 0 CA-C-O 121.609 0.718 . . . . 50.43 112.859 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -135.6 127.73 29.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 104.128 -2.545 . . . . 50.54 104.128 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -108.24 133.9 51.84 Favored 'General case' 0 CA--C 1.509 -0.629 0 C-N-CA 119.008 -1.077 . . . . 45.05 113.397 -172.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' VAL . . . . . . . . . . . . . 3.9 t -106.66 121.28 59.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.958 -1.127 . . . . 42.6 107.958 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' ARG . . . . . 0.586 ' NH1' HD11 ' A' ' 342' ' ' ILE . 38.3 ptt85 -156.68 161.18 39.87 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 118.917 -0.563 . . . . 43.19 111.997 -173.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -65.88 148.18 52.19 Favored 'General case' 1 CA--C 1.415 -4.246 0 N-CA-C 107.096 -1.446 . . . . 44.3 107.096 172.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.57 24.38 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.468 1.031 . . . . 45.63 112.68 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' GLY . . . . . . . . . . . . . . . -125.05 178.51 16.5 Favored Glycine 0 C--O 1.248 0.993 0 CA-C-N 114.686 -1.143 . . . . 47.61 110.954 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' ILE . . . . . 0.494 ' O ' HG12 ' A' ' 309' ' ' ILE . 0.1 OUTLIER -63.35 -38.37 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 115.3 -0.45 . . . . 51.23 112.008 -176.184 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -65.63 -10.68 38.03 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 114.864 1.431 . . . . 46.95 114.864 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -87.65 -7.59 57.25 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.714 2.116 . . . . 46.56 116.714 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' ILE . . . . . 0.532 HG23 HD23 ' A' ' 333' ' ' LEU . 33.9 mm -57.13 -54.36 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 118.445 0.566 . . . . 46.24 111.526 -176.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' GLY . . . . . . . . . . . . . . . -44.13 -52.16 7.1 Favored Glycine 0 CA--C 1.524 0.598 0 O-C-N 122.981 0.176 . . . . 44.56 113.211 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' GLY . . . . . . . . . . . . . . . -64.3 -36.06 92.73 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 114.733 0.653 . . . . 43.18 114.733 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' ILE . . . . . 0.541 HG22 HD12 ' A' ' 316' ' ' ILE . 67.2 mt -66.92 -43.18 89.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 CA-C-N 117.924 0.862 . . . . 42.32 109.517 176.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' LEU . . . . . . . . . . . . . 63.8 mt -58.17 -37.25 74.34 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.581 -0.736 . . . . 42.78 112.076 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -68.67 -34.48 75.76 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.82 -0.627 . . . . 45.22 109.652 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 14.4 mt -72.77 -37.55 67.59 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.747 -0.781 . . . . 45.3 110.217 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' ILE . . . . . 0.541 HD12 HG22 ' A' ' 312' ' ' ILE . 40.2 mt -81.14 -40.91 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 115.291 -0.868 . . . . 53.85 111.272 -171.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -50.14 -48.24 79.97 Favored Pre-proline 0 N--CA 1.474 0.732 0 N-CA-C 115.07 1.508 . . . . 58.61 115.07 -173.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -63.29 -22.19 72.08 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 N-CA-C 114.113 0.774 . . . . 54.72 114.113 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.88 -36.62 59.45 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.686 0.254 . . . . 59.3 111.686 174.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' GLU . . . . . 0.422 ' CD ' ' HB2' ' A' ' 327' ' ' ARG . 98.8 mt-10 -65.48 -44.08 88.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.865 0.866 . . . . 59.93 113.236 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -59.22 -37.09 76.64 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.715 0.806 . . . . 63.45 111.288 172.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -78.41 2.11 19.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.007 1.114 . . . . 64.05 114.007 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' GLY . . . . . . . . . . . . . . . 82.18 2.96 90.7 Favored Glycine 0 N--CA 1.473 1.108 0 N-CA-C 114.99 0.756 . . . . 63.91 114.99 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' ILE . . . . . . . . . . . . . 61.3 mt -74.39 -50.41 27.24 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.051 1.13 . . . . 65.06 114.051 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' LEU . . . . . 0.406 HD23 HG23 ' A' ' 316' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.566 0 N-CA-C 112.855 0.687 . . . . 65.14 112.855 -174.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' ARG . . . . . 0.422 ' HB2' ' CD ' ' A' ' 320' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.58 0.956 . . . . 66.61 113.58 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -100.89 111.8 24.1 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.836 1.05 . . . . 59.89 113.836 -178.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' SER . . . . . . . . . . . . . 67.3 p -66.28 161.69 21.73 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 123.436 0.46 . . . . 57.67 112.14 165.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 4.6 ttm105 -58.8 -45.8 89.06 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 121.098 -0.241 . . . . 54.83 111.233 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.33 -41.73 89.81 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 110.435 -0.209 . . . . 55.91 110.435 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.21 -44.59 95.01 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 120.615 0.245 . . . . 57.63 111.465 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' LEU . . . . . 0.532 HD23 HG23 ' A' ' 309' ' ' ILE . 4.4 tp -65.58 -38.68 90.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.238 -0.585 . . . . 49.38 111.717 176.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -57.83 -36.9 72.9 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.943 -0.473 . . . . 50.96 111.588 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -76.35 -21.53 56.0 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.728 1.011 . . . . 45.56 113.728 -175.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.484 ' OE2' ' OH ' ' A' ' 356' ' ' TYR 0.332 23.3 mt-10 -114.84 -0.7 13.4 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.985 0.914 . . . . 50.36 111.743 -172.835 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' ILE . . . . . 0.467 HD13 ' CD1' ' A' ' 309' ' ' ILE . 10.1 tp -46.95 -38.62 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 114.503 1.297 . . . . 43.41 114.503 -171.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' GLY . . . . . . . . . . . . . . . -54.79 -21.66 23.54 Favored Glycine 0 C--O 1.22 -0.738 0 N-CA-C 114.68 0.632 . . . . 42.05 114.68 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 30.8 mmtm -86.93 -14.29 42.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.492 0.646 . . . . 44.52 110.818 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -94.45 140.39 29.88 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 114.915 1.45 . . . . 38.37 114.915 -172.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' THR . . . . . . . . . . . . . 87.0 m -113.73 143.81 44.0 Favored 'General case' 0 C--O 1.252 1.218 0 N-CA-C 106.582 -1.636 . . . . 38.02 106.582 168.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' ILE . . . . . 0.586 HD11 ' NH1' ' A' ' 302' ' ' ARG . 0.2 OUTLIER -126.08 167.68 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 N-CA-C 114.924 1.453 . . . . 40.52 114.924 169.941 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' ILE . . . . . . . . . . . . . 15.4 mt -113.54 127.78 70.72 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 124.311 1.044 . . . . 35.92 108.956 165.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -114.8 129.13 56.64 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.72 1.608 . . . . 36.21 106.861 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -130.34 122.05 27.18 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 105.803 -1.925 . . . . 48.05 105.803 174.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 50.11 32.2 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.485 1.291 . . . . 43.21 114.485 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.17 76.64 Favored Glycine 0 C--N 1.332 0.324 0 CA-C-O 119.209 -0.773 . . . . 37.09 113.439 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' LEU . . . . . . . . . . . . . 32.0 tp -108.39 132.64 53.55 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.732 -0.84 . . . . 36.47 108.732 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' ILE . . . . . . . . . . . . . 27.8 mt -79.41 113.36 18.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.88 0 N-CA-C 108.352 -0.981 . . . . 38.86 108.352 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' ILE . . . . . . . . . . . . . 12.1 pt -114.41 3.51 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 O-C-N 123.872 0.733 . . . . 35.91 112.82 -172.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' GLY . . . . . . . . . . . . . . . -167.18 151.61 19.6 Favored Glycine 0 C--O 1.226 -0.352 0 N-CA-C 110.667 -0.973 . . . . 36.24 110.667 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.0 166.57 29.26 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.336 -0.616 . . . . 40.09 109.336 170.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -166.89 147.57 5.8 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 105.02 -2.215 . . . . 38.78 105.02 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' ALA . . . . . . . . . . . . . . . -116.15 148.44 40.33 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.009 0.818 . . . . 38.23 108.967 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' LEU . . . . . . . . . . . . . 19.5 tp -127.67 122.27 32.58 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.224 -0.658 . . . . 38.99 109.224 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' TYR . . . . . 0.484 ' OH ' ' OE2' ' A' ' 336' ' ' GLU . 92.4 m-85 -111.35 101.48 50.7 Favored Pre-proline 0 CA--C 1.513 -0.464 0 O-C-N 123.462 0.476 . . . . 39.4 110.574 -179.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.05 141.49 32.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 O-C-N 123.466 1.245 . . . . 40.3 112.67 -174.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -117.09 91.61 3.63 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 106.159 -1.793 . . . . 42.36 106.159 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 7.8 t -62.37 -53.23 57.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 114.219 1.192 . . . . 46.21 114.219 -161.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -68.14 -23.75 64.92 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.826 1.25 . . . . 56.43 113.059 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 58.0 mp0 -93.55 -7.28 44.63 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.377 -0.971 . . . . 47.68 108.377 176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 56.96 38.06 29.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.324 0.583 . . . . 45.8 111.276 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -127.16 159.33 34.57 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.759 -1.571 . . . . 40.07 106.759 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -147.16 138.93 24.24 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.481 0.657 . . . . 39.61 110.573 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' GLU . . . . . 0.629 ' OE1' ' HE2' ' A' ' 428' ' ' LYS . 88.8 tt0 -91.72 128.11 37.43 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.899 -1.046 . . . . 43.99 110.144 176.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' MSE . . . . . 0.561 ' HE1' ' CD1' ' A' ' 385' ' ' LEU . 2.6 ttm -91.51 118.38 30.53 Favored 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 107.37 -1.345 . . . . 38.42 107.37 168.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -131.83 172.15 12.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.183 -0.917 . . . . 39.48 110.445 -178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' CYS . . . . . . . . . . . . . 9.6 t 58.46 44.51 17.95 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 114.819 -1.082 . . . . 43.77 110.407 167.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.57 116.29 30.05 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 C-N-CA 124.801 1.241 . . . . 39.17 109.42 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -135.05 135.41 41.27 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.913 -0.315 . . . . 38.45 110.721 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' ILE . . . . . . . . . . . . . 39.5 mm -116.16 133.08 63.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.275 -1.009 . . . . 38.0 108.275 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -50.61 135.05 26.09 Favored Pre-proline 0 N--CA 1.446 -0.654 0 N-CA-C 109.137 -0.69 . . . . 38.38 109.137 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.67 -33.45 93.59 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 N-CA-C 115.266 1.218 . . . . 37.87 115.266 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -80.1 0.5 31.77 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.537 1.31 . . . . 39.54 114.537 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -125.99 22.71 7.3 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 114.173 1.175 . . . . 39.5 114.173 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' ARG . . . . . . . . . . . . . 7.9 mmm-85 -76.54 178.74 6.42 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.858 -0.423 . . . . 46.41 109.858 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 44.72 43.3 6.64 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.878 0.696 . . . . 48.8 112.878 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -133.13 23.99 3.83 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 109.638 -1.385 . . . . 45.85 109.638 175.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 26.9 m120 58.79 27.05 15.51 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.24 0.83 . . . . 47.23 113.24 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -77.04 -32.48 57.0 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 119.788 -0.765 . . . . 43.41 112.26 -174.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' GLY . . . . . . . . . . . . . . . -57.33 -46.32 91.91 Favored Glycine 0 C--O 1.242 0.609 0 C-N-CA 120.782 -0.723 . . . . 41.3 112.001 170.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.51 -43.58 96.8 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.432 0.634 . . . . 40.07 111.233 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 9.3 tp -51.0 -55.29 18.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.469 -0.787 . . . . 40.17 110.64 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 29.1 mt -58.1 -43.29 87.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.147 0.795 . . . . 38.19 113.147 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.561 ' CD1' ' HE1' ' A' ' 366' ' ' MSE . 24.7 tp -62.64 -47.82 82.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 119.938 -0.705 . . . . 38.02 110.695 -177.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' ASN . . . . . 0.404 HD22 ' HD3' ' A' ' 389' ' ' LYS . 7.4 m120 -63.35 -33.81 76.35 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 112.258 0.466 . . . . 42.88 112.258 -177.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -67.91 -41.09 83.18 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 123.997 0.81 . . . . 41.39 109.105 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' MSE . . . . . 0.468 ' HG3' 'SE ' ' A' ' 366' ' ' MSE . 5.2 mmt -65.48 -49.25 69.77 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.199 -0.455 . . . . 48.51 110.233 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' LYS . . . . . 0.404 ' HD3' HD22 ' A' ' 386' ' ' ASN . 60.9 mtpt -48.75 -55.53 11.21 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.574 -0.528 . . . . 43.95 109.574 175.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' HIS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 393' ' ' LYS . 39.9 t-80 -59.83 -39.1 83.96 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.611 0.967 . . . . 47.82 113.611 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -69.84 -45.09 68.58 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 123.592 0.557 . . . . 53.03 112.125 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' SER . . . . . . . . . . . . . 57.1 m -59.46 -45.47 91.53 Favored 'General case' 0 CA--C 1.497 -1.083 0 O-C-N 123.388 0.43 . . . . 46.9 111.642 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 390' ' ' HIS . 18.2 mtmt -53.01 -44.7 67.5 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 124.246 0.966 . . . . 51.92 110.256 179.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 4.5 p -74.8 -3.04 29.38 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.656 1.354 . . . . 48.56 114.656 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -111.68 21.5 16.02 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.808 -0.558 . . . . 53.55 112.458 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' ASN . . . . . . . . . . . . . 55.0 t30 70.75 22.62 4.79 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.364 1.066 . . . . 45.6 113.56 176.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' ILE . . . . . . . . . . . . . 13.5 mt -101.34 132.61 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.543 1.137 . . . . 43.34 110.447 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 32.5 p30 -117.87 4.22 12.19 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 114.657 1.354 . . . . 45.0 114.657 -172.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -144.65 139.83 28.27 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 113.582 0.956 . . . . 44.94 113.582 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' ILE . . . . . . . . . . . . . 8.2 mt -111.11 140.28 31.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 108.217 -1.031 . . . . 39.48 108.217 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 365' ' ' GLU . 50.2 p90 -130.88 153.67 48.89 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 120.596 -0.442 . . . . 39.94 111.125 172.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.76 153.23 38.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.193 -1.04 . . . . 42.12 108.193 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.39 115.33 28.55 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 105.111 -2.181 . . . . 50.51 105.111 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' THR . . . . . . . . . . . . . 11.6 t -142.53 155.3 45.01 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.033 -0.667 . . . . 49.59 111.333 -168.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' THR . . . . . . . . . . . . . 55.0 p -121.53 -4.22 9.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.622 -1.251 . . . . 52.25 107.622 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -120.72 149.45 42.5 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.723 1.209 . . . . 56.19 109.354 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' SER . . . . . . . . . . . . . 19.0 m 68.29 39.2 2.34 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.338 1.977 . . . . 57.08 116.338 165.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.25 -44.31 88.24 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 115.01 1.485 . . . . 58.35 115.01 177.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -55.07 -46.78 75.44 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 122.896 0.123 . . . . 52.99 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -63.91 -46.33 85.3 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.906 0.706 . . . . 50.84 112.906 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -61.9 -48.3 81.07 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.825 -0.625 . . . . 49.04 111.633 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' ARG . . . . . . . . . . . . . 19.6 ttm105 -55.31 -44.31 75.66 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.076 0.465 . . . . 61.27 110.093 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.12 -24.82 60.17 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 113.465 0.913 . . . . 54.52 113.465 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -90.8 -3.52 57.35 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.724 1.009 . . . . 46.11 113.724 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . 101.22 9.81 43.75 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 112.014 -0.434 . . . . 40.36 112.014 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.58 142.33 55.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 122.381 0.272 . . . . 38.01 110.334 171.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -129.64 156.08 44.81 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.214 -0.661 . . . . 38.45 109.214 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -84.38 137.22 33.52 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 120.12 -0.632 . . . . 35.08 110.566 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.04 164.32 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.518 -0.764 . . . . 35.61 110.234 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' GLY . . . . . . . . . . . . . . . -86.84 170.35 41.69 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-O 119.524 -0.598 . . . . 36.3 113.296 174.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 1.9 m -61.31 -27.91 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 113.324 0.861 . . . . 38.01 113.324 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -60.23 -21.65 62.07 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 114.29 1.218 . . . . 41.29 114.29 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -71.09 -31.37 67.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 110.207 -0.294 . . . . 40.49 110.207 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.6 137.75 61.93 Favored Pre-proline 0 C--O 1.245 0.834 0 N-CA-C 114.163 1.172 . . . . 39.93 114.163 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.28 133.88 52.17 Favored 'Trans proline' 0 C--O 1.239 0.54 0 N-CA-C 108.782 -1.276 . . . . 41.96 108.782 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -36.96 -36.52 0.18 Allowed Glycine 0 N--CA 1.477 1.406 0 N-CA-C 117.368 1.707 . . . . 42.6 117.368 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.98 94.71 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.828 -0.749 . . . . 47.17 109.506 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' LYS . . . . . 0.629 ' HE2' ' OE1' ' A' ' 365' ' ' GLU . 0.6 OUTLIER -85.57 -0.58 55.44 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 114.706 -1.134 . . . . 50.48 111.365 -173.805 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.17 -46.71 22.48 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.579 1.326 . . . . 53.55 114.579 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -46.07 -26.81 2.28 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 115.133 0.813 . . . . 53.51 115.133 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . . . -95.02 -39.29 10.24 Favored 'General case' 0 C--O 1.248 0.996 0 N-CA-C 116.132 1.901 . . . . 53.78 116.132 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . . . -58.84 -38.45 78.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 122.55 0.34 . . . . 53.4 110.32 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . . . -90.82 33.95 0.92 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.834 -0.621 . . . . 52.25 111.75 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' PHE . . . . . . . . . . . . . 22.6 t80 . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 114.044 1.127 . . . . 51.45 114.044 178.086 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' ARG . . . . . 0.493 ' HG3' ' H ' ' A' ' 437' ' ' LYS . 6.1 ptm180 . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 112.829 0.678 . . . . 67.2 112.829 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.493 ' H ' ' HG3' ' A' ' 436' ' ' ARG . . . -73.99 38.0 0.1 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 120.997 0.427 . . . . 61.79 112.011 170.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' SER . . . . . . . . . . . . . 31.1 t -107.38 112.76 25.72 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.748 1.018 . . . . 57.22 113.748 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -100.77 148.51 24.83 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.376 -0.827 . . . . 50.69 112.755 -170.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' ILE . . . . . . . . . . . . . 21.0 mt -102.47 121.66 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 108.012 -1.107 . . . . 43.5 108.012 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 53.4 mt -119.05 136.12 54.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.731 -0.388 . . . . 39.01 111.76 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -117.18 151.85 36.0 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.384 0.883 . . . . 35.81 113.384 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' LEU . . . . . . . . . . . . . 38.5 tp -132.3 123.18 26.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 38.36 109.338 -178.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -76.31 120.57 21.75 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.417 0.627 . . . . 44.73 110.969 174.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 CA--C 1.514 -0.409 0 N-CA-C 108.773 -0.825 . . . . 39.93 108.773 -178.357 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . 0.406 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_