data_3r4h_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 3r4h _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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 113.907 0.323 . . . . 64.609999999999999 113.907 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -64.04 -41.02 97.55 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.504 -0.409 . . . . 73.730000000000004 109.911 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mp -70.8 -47.69 58.12 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.034 -0.666 . . . . 70.450000000000003 111.933 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.09 -47.1 68.81 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.756 0.789 . . . . 65.859999999999999 109.868 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -49.64 -48.1 49.44 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.413 -0.812 . . . . 52.619999999999997 109.997 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 41.1 mt -64.34 -47.39 89.83 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 CA-C-N 115.69 -0.687 . . . . 58.710000000000001 110.722 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . 0.461 ' NZ ' ' OE2' ' D' ' 2' ' ' GLU . 26.7 ttpt -53.36 -45.23 69.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.613 -1.255 . . . . 73.629999999999995 107.613 176.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.4 -47.09 87.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.213 -0.903 . . . . 71.239999999999995 111.716 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.94 -39.72 75.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 123.422 0.451 . . . . 84.950000000000003 110.832 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.31 -38.34 87.5 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.813 -0.755 . . . . 51.020000000000003 111.621 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.03 90.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.796 -0.816 . . . . 52.350000000000001 108.796 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.07 -53.01 62.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.802 -0.635 . . . . 52.539999999999999 111.129 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.2 mt -54.93 -36.08 36.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 112.464 0.542 . . . . 48.270000000000003 112.464 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.1 ttpt -59.09 -53.82 54.06 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.684 0.754 . . . . 74.329999999999998 111.119 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -62.23 -35.52 79.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.689 -0.687 . . . . 105.7 111.487 -175.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -62.78 -48.28 79.83 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.451 -0.795 . . . . 99.230000000000004 110.431 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 77.0 mt -54.38 -40.55 68.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 120.154 -0.618 . . . . 50.240000000000002 110.728 172.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.76 -56.74 16.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.422 0.63 . . . . 57.039999999999999 111.094 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.19 -47.57 45.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.595 0.712 . . . . 59.890000000000001 111.627 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.8 mt -58.68 -37.93 68.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 122.096 0.95 . . . . 57.640000000000001 111.191 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -61.49 -57.3 12.72 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.852 -1.067 . . . . 62.859999999999999 109.941 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.8 -24.6 66.95 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.121 0.873 . . . . 81.510000000000005 112.68 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.32 -29.03 42.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.288 0.847 . . . . 56.909999999999997 113.288 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.74 -33.42 46.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.384 -0.598 . . . . 53.450000000000003 109.384 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.79 62.8 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.489 -0.778 . . . . 59.840000000000003 110.084 173.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.9 mt -68.38 -35.68 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 N-CA-C 112.628 0.603 . . . . 60.539999999999999 112.628 -175.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -51.72 -27.65 12.55 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 109.281 -0.637 . . . . 78.159999999999997 109.281 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 105.422 -2.066 . . . . 84.819999999999993 105.422 -171.799 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.699 . . . . . . . . 71.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -83.25 162.26 40.09 Favored Glycine 0 C--N 1.331 0.3 0 N-CA-C 110.264 -1.134 . . . . 60.340000000000003 110.264 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -82.62 -43.87 16.47 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 119.458 -0.897 . . . . 63.880000000000003 110.873 173.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.57 -48.51 79.15 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.982 -1.859 . . . . 56.829999999999998 105.982 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.58 -53.04 42.34 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.125 -0.943 . . . . 57.969999999999999 112.831 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.74 -35.23 68.34 Favored 'General case' 0 C--O 1.244 0.81 0 CA-C-O 121.071 0.462 . . . . 59.890000000000001 111.406 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 48.4 mt -62.37 -55.69 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.541 -0.754 . . . . 54.609999999999999 110.144 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -52.56 -29.04 23.45 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.796 0.665 . . . . 54.460000000000001 112.796 174.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -73.72 -39.54 64.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.855 -0.738 . . . . 87.480000000000004 109.669 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.66 -37.96 89.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.621 0.576 . . . . 86.010000000000005 111.63 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.68 -51.74 66.04 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.988 -0.551 . . . . 48.840000000000003 110.42 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.3 -40.66 68.11 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.049 -0.523 . . . . 51.140000000000001 109.774 176.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.34 98.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.316 0.579 . . . . 51.310000000000002 111.404 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 58.0 mt -62.46 -53.38 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.678 -0.692 . . . . 45.390000000000001 110.041 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt -51.34 -28.06 11.31 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.293 0.568 . . . . 74.230000000000004 109.894 176.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -76.07 -35.21 59.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.737 1.384 . . . . 71.409999999999997 114.737 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -70.18 -42.69 72.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 118.276 -1.37 . . . . 70.909999999999997 109.217 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mt -49.13 -51.44 32.09 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.954 0.724 . . . . 53.659999999999997 112.954 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.57 -50.4 53.73 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.139 -0.482 . . . . 53.399999999999999 111.872 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.22 -51.04 70.93 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.336 -0.616 . . . . 54.560000000000002 109.336 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 10.3 mt -54.65 -53.49 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 N-CA-C 113.375 0.879 . . . . 50.369999999999997 113.375 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -55.8 -25.43 41.46 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.101 0.778 . . . . 86.189999999999998 113.101 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.34 -33.84 68.15 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 111.363 0.135 . . . . 69.109999999999999 111.363 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.25 -49.09 37.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.489 0.662 . . . . 50.030000000000001 110.202 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.29 -42.98 70.67 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.031 -0.986 . . . . 50.799999999999997 109.649 173.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.5 -56.86 15.46 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.05 -0.523 . . . . 59.229999999999997 110.665 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.6 mt -49.16 -44.57 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 CA-C-N 115.833 -0.621 . . . . 58.909999999999997 112.632 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -82.26 4.58 23.08 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 118.463 -1.295 . . . . 61.609999999999999 111.011 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -98.02 6.97 47.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.654 0.983 . . . . 69.420000000000002 113.654 166.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.518 0 C-N-CA 121.072 -0.585 . . . . 81.219999999999999 112.152 179.82 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 120.978 0.21 . . . . 57.68 112.756 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.75 -50.47 29.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.34 0.59 . . . . 61.890000000000001 110.439 -179.582 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 31.9 mt -64.98 -54.59 28.01 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.562 0.949 . . . . 68.989999999999995 113.562 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -27.45 56.42 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.08 -0.964 . . . . 62.359999999999999 111.923 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.36 -26.19 35.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.518 0.675 . . . . 61.119999999999997 112.017 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -50.91 -53.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 113.457 0.91 . . . . 52.770000000000003 113.457 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.4 -43.05 54.46 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.586 -0.894 . . . . 64.0 108.586 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -45.86 79.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.549 -0.296 . . . . 84.079999999999998 110.263 179.433 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLU . . . . . 0.57 ' OE1' ' NZ ' ' D' ' 14' ' ' LYS . 3.3 mt-10 -57.42 -43.31 83.68 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.517 -0.473 . . . . 81.829999999999998 112.214 -178.588 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 61.2 mt -64.29 -50.28 68.49 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.452 0.644 . . . . 51.420000000000002 112.007 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.13 -44.62 52.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 56.560000000000002 112.056 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.35 -44.51 92.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.02 0.438 . . . . 50.840000000000003 110.285 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.19 -45.95 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 43.869999999999997 110.723 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -52.51 -48.59 65.93 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 124.407 1.067 . . . . 71.879999999999995 110.464 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt -61.64 -28.94 69.74 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.832 -0.747 . . . . 72.620000000000005 109.608 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.23 -39.2 55.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.821 0.82 . . . . 92.140000000000001 109.844 -174.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 66.9 mt -68.53 -40.92 80.55 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.527 -0.76 . . . . 49.969999999999999 109.894 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.81 96.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.384 0.611 . . . . 58.210000000000001 109.878 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.18 -53.97 36.64 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.613 -0.721 . . . . 60.130000000000003 109.292 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 81.6 mt -59.22 -36.32 62.54 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 N-CA-C 113.041 0.756 . . . . 54.399999999999999 113.041 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -66.42 -32.08 73.24 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.516 1.302 . . . . 68.219999999999999 114.516 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -63.36 -50.92 68.05 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.037 -1.438 . . . . 84.560000000000002 111.159 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.87 -41.27 83.09 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.147 -0.933 . . . . 69.049999999999997 110.807 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.76 -40.11 75.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.825 -0.805 . . . . 72.810000000000002 108.825 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.86 -57.5 9.66 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.525 0.565 . . . . 70.469999999999999 112.525 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mp -54.12 -31.35 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.885 -0.598 . . . . 70.659999999999997 109.663 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -55.63 -25.04 36.86 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.388 -0.597 . . . . 70.790000000000006 109.388 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.48 9.69 28.26 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 116.302 1.964 . . . . 97.670000000000002 116.302 -177.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 O-C-N 121.448 -0.783 . . . . 87.900000000000006 113.9 171.649 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 108.581 -1.808 . . . . 66.170000000000002 108.581 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' GLU . . . . . 0.461 ' OE2' ' NZ ' ' A' ' 7' ' ' LYS . 1.7 tp10 -64.86 -38.46 91.05 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.036 -0.728 . . . . 91.299999999999997 109.036 170.722 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 14.1 tp -59.02 -37.31 76.64 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 124.107 0.879 . . . . 63.859999999999999 110.597 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.59 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.402 -0.817 . . . . 62.700000000000003 110.308 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.82 -50.28 72.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 124.04 0.838 . . . . 59.590000000000003 108.925 179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.64 -54.85 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.918 -1.037 . . . . 53.479999999999997 113.661 173.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 32.5 mttm -56.33 -30.51 62.7 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.959 0.885 . . . . 75.079999999999998 111.532 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -74.24 -40.69 62.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.134 -1.393 . . . . 93.239999999999995 109.319 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -59.26 -48.09 82.93 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.188 -0.46 . . . . 77.200000000000003 112.175 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' LEU . . . . . . . . . . . . . 28.1 mt -56.23 -37.76 70.15 Favored 'General case' 0 CA--C 1.504 -0.816 0 O-C-N 121.782 -0.574 . . . . 52.140000000000001 110.708 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.59 -50.82 65.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 53.259999999999998 110.27 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.41 -42.34 63.98 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.456 0.646 . . . . 53.289999999999999 111.389 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.41 -45.01 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-N 115.704 -0.68 . . . . 46.130000000000003 110.886 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' LYS . . . . . 0.57 ' NZ ' ' OE1' ' C' ' 9' ' ' GLU . 44.5 mtmt -63.49 -30.63 71.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.125 -1.03 . . . . 64.569999999999993 109.751 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -57.14 -65.96 0.53 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 119.577 -0.849 . . . . 81.159999999999997 112.028 168.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -49.63 -37.03 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.039 0.755 . . . . 74.260000000000005 113.039 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 16.0 mt -65.61 -37.06 85.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 119.071 -1.051 . . . . 53.240000000000002 110.521 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -46.57 78.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.018 -0.734 . . . . 59.520000000000003 109.018 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.11 75.05 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.384 1.253 . . . . 52.25 114.384 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 14.5 mt -66.21 -47.23 85.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 120.775 -0.37 . . . . 52.170000000000002 110.546 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -59.11 -35.58 73.68 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.958 -0.564 . . . . 82.430000000000007 111.829 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -62.33 -53.27 57.52 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 108.347 -0.982 . . . . 71.829999999999998 108.347 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' LEU . . . . . . . . . . . . . 7.8 mt -47.51 -33.27 6.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.235 0.828 . . . . 62.840000000000003 113.235 -178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -27.83 32.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.435 0.531 . . . . 60.039999999999999 112.435 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.72 -38.62 75.61 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.839 0.828 . . . . 67.489999999999995 110.912 170.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 115.822 -0.626 . . . . 59.119999999999997 110.446 175.642 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' E' ' 50' ' ' HOH . 1.9 tm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.472 0.653 . . . . 83.790000000000006 112.509 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.53 24.28 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.618 -1.253 . . . . 85.430000000000007 107.618 -179.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.81 -14.14 19.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.694 0.998 . . . . 90.040000000000006 113.694 -175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.37 -49.76 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-N 116.377 -0.374 . . . . 77.439999999999998 110.473 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -57.85 -25.8 61.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.447 -0.797 . . . . 102.62 110.653 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -61.01 -49.17 78.51 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 107.665 -1.235 . . . . 93.230000000000004 107.665 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -68.46 -48.61 64.07 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 108.049 -1.093 . . . . 84.629999999999995 108.049 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 45.7 mt -51.27 -33.69 29.53 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.691 0.757 . . . . 79.439999999999998 109.357 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.54 -46.01 41.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.191 -0.913 . . . . 58.43 110.103 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.1 -31.9 73.33 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.348 -0.612 . . . . 57.799999999999997 109.348 -175.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ILE . . . . . . . . . . . . . 18.0 mt -70.65 -50.56 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 CA-C-N 114.851 -1.068 . . . . 51.799999999999997 109.684 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' LYS . . . . . . . . . . . . . 9.7 mttp -62.9 -18.1 62.57 Favored 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 123.562 0.539 . . . . 71.700000000000003 109.555 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -76.66 -45.89 27.94 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.327 -0.851 . . . . 69.840000000000003 109.546 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.2 -29.65 70.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.014 -0.539 . . . . 70.269999999999996 111.987 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.41 -42.26 88.05 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.952 -0.699 . . . . 60.020000000000003 110.757 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.33 83.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.595 -0.73 . . . . 50.600000000000001 109.679 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.14 82.91 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.179 -0.675 . . . . 52.43 109.179 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' ILE . . . . . . . . . . . . . 4.4 mt -57.73 -42.7 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.598 -0.728 . . . . 49.469999999999999 110.698 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -60.99 -39.01 88.02 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 119.213 -0.995 . . . . 97.640000000000001 113.045 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -59.41 -43.37 93.02 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.626 0.726 . . . . 53.5 109.57 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.39 -44.28 97.42 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 116.154 -0.475 . . . . 47.270000000000003 111.424 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.67 67.16 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.498 0.665 . . . . 47.950000000000003 110.898 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.95 -45.11 28.87 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 115.483 -0.781 . . . . 55.399999999999999 108.954 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' ILE . . . . . . . . . . . . . 13.7 mt -53.66 -47.16 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 114.69 -1.141 . . . . 50.82 109.429 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -63.85 -5.6 4.61 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.556 -0.747 . . . . 82.390000000000001 112.883 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 119.517 -0.873 . . . . 90.890000000000001 111.291 168.938 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.317 0.58 . . . . 76.620000000000005 111.745 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.8 -41.91 20.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.017 1.117 . . . . 84.099999999999994 114.017 178.1 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.11 -15.84 63.52 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 106.083 -1.821 . . . . 83.219999999999999 106.083 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.9 -58.66 6.1 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.07 -1.085 . . . . 75.540000000000006 108.07 171.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' ILE . . . . . . . . . . . . . 10.7 mt -56.75 -56.5 13.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 114.845 1.424 . . . . 77.920000000000002 114.845 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.12 -34.08 29.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.273 0.558 . . . . 91.709999999999994 111.196 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -73.38 -28.81 62.23 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.811 -0.631 . . . . 106.56 111.6 -175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -75.82 -40.5 54.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.78 -0.646 . . . . 104.01000000000001 111.807 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 74.1 mt -58.85 -40.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.805 0.812 . . . . 61.729999999999997 109.441 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.04 -36.6 79.99 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.288 -1.375 . . . . 70.239999999999995 107.288 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.46 -38.93 74.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.583 0.706 . . . . 60.020000000000003 109.862 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -67.05 -43.28 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.179 -0.919 . . . . 56.280000000000001 111.184 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -54.63 -41.43 70.02 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.553 0.692 . . . . 74.769999999999996 109.79 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -37.17 81.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.803 -0.759 . . . . 83.950000000000003 110.469 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.4 -44.66 95.48 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 119.331 -0.948 . . . . 99.739999999999995 108.824 175.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' LEU . . . . . . . . . . . . . 27.3 mt -63.75 -45.18 91.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.685 -0.806 . . . . 47.960000000000001 112.769 -174.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.75 70.07 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 120.427 -0.509 . . . . 51.759999999999998 110.736 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.8 -36.33 75.59 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.911 -0.716 . . . . 53.229999999999997 110.478 -175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' ILE . . . . . . . . . . . . . 57.1 mt -59.04 -49.95 81.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-N 115.372 -0.831 . . . . 53.439999999999998 110.097 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -48.52 -49.16 37.25 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 113.602 0.964 . . . . 62.670000000000002 113.602 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' PHI . . . . . 0.648 ' I ' ' O ' ' B' ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -41.59 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.465 0.913 . . . . 94.950000000000003 113.465 175.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.22 -48.29 76.41 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 112.319 0.488 . . . . 46.549999999999997 112.319 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' F' ' 29' ' ' GLN . . . -52.13 -48.48 64.84 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 115.929 -0.578 . . . . 46.990000000000002 109.649 176.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.3 92.88 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.479 -0.782 . . . . 45.530000000000001 109.993 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' ILE . . . . . . . . . . . . . 15.9 mm -56.83 -50.11 76.34 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.791 -0.641 . . . . 61.670000000000002 109.995 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -61.49 -46.68 88.98 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.794 -0.639 . . . . 64.120000000000005 109.88 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' F' ' 25' ' ' ALA . 1.4 tp-100 -49.68 -38.57 33.26 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.453 -0.499 . . . . 81.700000000000003 110.672 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.455 0 CA-C-N 115.981 -0.554 . . . . 73.859999999999999 113.437 -178.992 . . . . . . . . 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 ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' HOH . . . . . 0.648 ' O ' ' I ' ' F' ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 50' ' ' HOH . . . . . 0.527 ' O ' ' N ' ' E' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 113.907 0.323 . . . . 64.61 113.907 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -64.04 -41.02 97.55 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.504 -0.409 . . . . 73.73 109.911 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mp -70.8 -47.69 58.12 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.034 -0.666 . . . . 70.45 111.933 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.09 -47.1 68.81 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.756 0.789 . . . . 65.86 109.868 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -49.64 -48.1 49.44 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.413 -0.812 . . . . 52.62 109.997 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 41.1 mt -64.34 -47.39 89.83 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 CA-C-N 115.69 -0.687 . . . . 58.71 110.722 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.591 ' HD3' ' HB1' ' D' ' 5' ' ' ALA . 26.7 ttpt -53.36 -45.23 69.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.613 -1.255 . . . . 73.63 107.613 176.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.4 -47.09 87.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.213 -0.903 . . . . 71.24 111.716 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.94 -39.72 75.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 123.422 0.451 . . . . 84.95 110.832 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.31 -38.34 87.5 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.813 -0.755 . . . . 51.02 111.621 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.03 90.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.796 -0.816 . . . . 52.35 108.796 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 36' ' ' HOH . . . -56.07 -53.01 62.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.802 -0.635 . . . . 52.54 111.129 -179.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.2 mt -54.93 -36.08 36.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 112.464 0.542 . . . . 48.27 112.464 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.1 ttpt -59.09 -53.82 54.06 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.684 0.754 . . . . 74.33 111.119 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 18' ' ' ALA . 46.1 mttp -62.23 -35.52 79.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.689 -0.687 . . . . 105.7 111.487 -175.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -62.78 -48.28 79.83 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.451 -0.795 . . . . 99.23 110.431 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 77.0 mt -54.38 -40.55 68.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 120.154 -0.618 . . . . 50.24 110.728 172.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 15' ' ' LYS . . . -55.76 -56.74 16.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.422 0.63 . . . . 57.04 111.094 177.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.19 -47.57 45.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.595 0.712 . . . . 59.89 111.627 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.8 mt -58.68 -37.93 68.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 122.096 0.95 . . . . 57.64 111.191 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -61.49 -57.3 12.72 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.852 -1.067 . . . . 62.86 109.941 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.8 -24.6 66.95 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.121 0.873 . . . . 81.51 112.68 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.32 -29.03 42.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.288 0.847 . . . . 56.91 113.288 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.74 -33.42 46.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.384 -0.598 . . . . 53.45 109.384 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.79 62.8 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.489 -0.778 . . . . 59.84 110.084 173.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . 0.688 HD13 HG21 ' B' ' 27' ' ' ILE . 8.9 mt -68.38 -35.68 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 N-CA-C 112.628 0.603 . . . . 60.54 112.628 -175.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -51.72 -27.65 12.55 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 109.281 -0.637 . . . . 78.16 109.281 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 105.422 -2.066 . . . . 84.82 105.422 -171.799 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.699 . . . . . . . . 71.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -83.25 162.26 40.09 Favored Glycine 0 C--N 1.331 0.3 0 N-CA-C 110.264 -1.134 . . . . 60.34 110.264 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -82.62 -43.87 16.47 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 119.458 -0.897 . . . . 63.88 110.873 173.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.57 -48.51 79.15 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.982 -1.859 . . . . 56.83 105.982 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.58 -53.04 42.34 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.125 -0.943 . . . . 57.97 112.831 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.74 -35.23 68.34 Favored 'General case' 0 C--O 1.244 0.81 0 CA-C-O 121.071 0.462 . . . . 59.89 111.406 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 48.4 mt -62.37 -55.69 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.541 -0.754 . . . . 54.61 110.144 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -52.56 -29.04 23.45 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.796 0.665 . . . . 54.46 112.796 174.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -73.72 -39.54 64.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.855 -0.738 . . . . 87.48 109.669 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLU . . . . . 0.425 ' OE2' ' HA ' ' B' ' 9' ' ' GLU . 1.7 mm-40 -64.66 -37.96 89.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.621 0.576 . . . . 86.01 111.63 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.68 -51.74 66.04 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.988 -0.551 . . . . 48.84 110.42 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . 0.417 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . . . -54.3 -40.66 68.11 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.049 -0.523 . . . . 51.14 109.774 176.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.34 98.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.316 0.579 . . . . 51.31 111.404 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 58.0 mt -62.46 -53.38 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.678 -0.692 . . . . 45.39 110.041 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' B' ' 11' ' ' ALA . 28.5 mtmt -51.34 -28.06 11.31 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.293 0.568 . . . . 74.23 109.894 176.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -76.07 -35.21 59.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.737 1.384 . . . . 71.41 114.737 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -70.18 -42.69 72.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 118.276 -1.37 . . . . 70.91 109.217 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mt -49.13 -51.44 32.09 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.954 0.724 . . . . 53.66 112.954 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.57 -50.4 53.73 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.139 -0.482 . . . . 53.4 111.872 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' B' ' 22' ' ' PHI . . . -57.22 -51.04 70.93 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.336 -0.616 . . . . 54.56 109.336 178.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 10.3 mt -54.65 -53.49 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 N-CA-C 113.375 0.879 . . . . 50.37 113.375 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -55.8 -25.43 41.46 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.101 0.778 . . . . 86.19 113.101 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PHI . . . . . 0.427 ' HB2' ' O ' ' B' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.34 -33.84 68.15 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 111.363 0.135 . . . . 69.11 111.363 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.25 -49.09 37.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.489 0.662 . . . . 50.03 110.202 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.29 -42.98 70.67 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.031 -0.986 . . . . 50.8 109.649 173.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.5 -56.86 15.46 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.05 -0.523 . . . . 59.23 110.665 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ILE . . . . . 0.688 HG21 HD13 ' A' ' 27' ' ' ILE . 6.6 mt -49.16 -44.57 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 CA-C-N 115.833 -0.621 . . . . 58.91 112.632 -177.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -82.26 4.58 23.08 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 118.463 -1.295 . . . . 61.61 111.011 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -98.02 6.97 47.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.654 0.983 . . . . 69.42 113.654 166.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.518 0 C-N-CA 121.072 -0.585 . . . . 81.22 112.152 179.82 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 120.978 0.21 . . . . 57.68 112.756 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.75 -50.47 29.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.34 0.59 . . . . 61.89 110.439 -179.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 31.9 mt -64.98 -54.59 28.01 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.562 0.949 . . . . 68.99 113.562 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -27.45 56.42 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.08 -0.964 . . . . 62.36 111.923 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.36 -26.19 35.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.518 0.675 . . . . 61.12 112.017 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -50.91 -53.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 113.457 0.91 . . . . 52.77 113.457 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.4 -43.05 54.46 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.586 -0.894 . . . . 64.0 108.586 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -45.86 79.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.549 -0.296 . . . . 84.08 110.263 179.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLU . . . . . 0.5 ' OE1' ' NZ ' ' D' ' 14' ' ' LYS . 3.3 mt-10 -57.42 -43.31 83.68 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.517 -0.473 . . . . 81.83 112.214 -178.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 61.2 mt -64.29 -50.28 68.49 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.452 0.644 . . . . 51.42 112.007 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.13 -44.62 52.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 56.56 112.056 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.35 -44.51 92.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.02 0.438 . . . . 50.84 110.285 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.19 -45.95 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 43.87 110.723 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LYS . . . . . 0.609 ' HD3' ' C ' ' C' ' 14' ' ' LYS . 8.5 tmtt? -52.51 -48.59 65.93 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 124.407 1.067 . . . . 71.88 110.464 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . 0.461 ' HE2' ' HB3' ' C' ' 15' ' ' LYS . 3.8 mtpt -61.64 -28.94 69.74 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.832 -0.747 . . . . 72.62 109.608 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' GLU . . . . . 0.565 ' HG2' HD13 ' D' ' 17' ' ' LEU . 0.6 OUTLIER -76.23 -39.2 55.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.821 0.82 . . . . 92.14 109.844 -174.263 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 66.9 mt -68.53 -40.92 80.55 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.527 -0.76 . . . . 49.97 109.894 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.81 96.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.384 0.611 . . . . 58.21 109.878 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' C' ' 23' ' ' GLU . . . -52.18 -53.97 36.64 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.613 -0.721 . . . . 60.13 109.292 174.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ILE . . . . . 0.588 ' O ' ' HB2' ' C' ' 23' ' ' GLU . 81.6 mt -59.22 -36.32 62.54 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 N-CA-C 113.041 0.756 . . . . 54.4 113.041 -179.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . 0.424 ' O ' ' HG2' ' C' ' 21' ' ' LYS . 20.6 ttpt -66.42 -32.08 73.24 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.516 1.302 . . . . 68.22 114.516 176.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLU . . . . . 0.588 ' HB2' ' O ' ' C' ' 20' ' ' ILE . 8.4 mm-40 -63.36 -50.92 68.05 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.037 -1.438 . . . . 84.56 111.159 179.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.87 -41.27 83.09 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.147 -0.933 . . . . 69.05 110.807 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ALA . . . . . 0.467 ' O ' ' HB3' ' C' ' 28' ' ' LYS . . . -56.76 -40.11 75.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.825 -0.805 . . . . 72.81 108.825 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.86 -57.5 9.66 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.525 0.565 . . . . 70.47 112.525 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mp -54.12 -31.35 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.885 -0.598 . . . . 70.66 109.663 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' C' ' 25' ' ' ALA . 29.3 ttpt -55.63 -25.04 36.86 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.388 -0.597 . . . . 70.79 109.388 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.48 9.69 28.26 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 116.302 1.964 . . . . 97.67 116.302 -177.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 30' ' ' GLY . . . . . 0.564 ' HA3' ' O ' ' C' ' 35' ' ' HOH . . . . . . . . 0 CA--C 1.524 0.637 0 O-C-N 121.448 -0.783 . . . . 87.9 113.9 171.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 108.581 -1.808 . . . . 66.17 108.581 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.86 -38.46 91.05 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.036 -0.728 . . . . 91.3 109.036 170.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 14.1 tp -59.02 -37.31 76.64 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 124.107 0.879 . . . . 63.86 110.597 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.59 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.402 -0.817 . . . . 62.7 110.308 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ALA . . . . . 0.591 ' HB1' ' HD3' ' A' ' 7' ' ' LYS . . . -56.82 -50.28 72.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 124.04 0.838 . . . . 59.59 108.925 179.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.64 -54.85 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.918 -1.037 . . . . 53.48 113.661 173.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 32.5 mttm -56.33 -30.51 62.7 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.959 0.885 . . . . 75.08 111.532 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -74.24 -40.69 62.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.134 -1.393 . . . . 93.24 109.319 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -59.26 -48.09 82.93 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.188 -0.46 . . . . 77.2 112.175 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' D' ' 10' ' ' LEU . 28.1 mt -56.23 -37.76 70.15 Favored 'General case' 0 CA--C 1.504 -0.816 0 O-C-N 121.782 -0.574 . . . . 52.14 110.708 178.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.59 -50.82 65.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 53.26 110.27 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ALA . . . . . 0.7 ' HA ' ' HE3' ' D' ' 15' ' ' LYS . . . -52.41 -42.34 63.98 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.456 0.646 . . . . 53.29 111.389 176.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.41 -45.01 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-N 115.704 -0.68 . . . . 46.13 110.886 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' LYS . . . . . 0.5 ' NZ ' ' OE1' ' C' ' 9' ' ' GLU . 44.5 mtmt -63.49 -30.63 71.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.125 -1.03 . . . . 64.57 109.751 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LYS . . . . . 0.7 ' HE3' ' HA ' ' D' ' 12' ' ' ALA . 2.3 mtmt -57.14 -65.96 0.53 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 119.577 -0.849 . . . . 81.16 112.028 168.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -49.63 -37.03 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.039 0.755 . . . . 74.26 113.039 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . 0.565 HD13 ' HG2' ' C' ' 16' ' ' GLU . 16.0 mt -65.61 -37.06 85.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 119.071 -1.051 . . . . 53.24 110.521 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -46.57 78.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.018 -0.734 . . . . 59.52 109.018 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.11 75.05 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.384 1.253 . . . . 52.25 114.384 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 14.5 mt -66.21 -47.23 85.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 120.775 -0.37 . . . . 52.17 110.546 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' D' ' 17' ' ' LEU . 40.3 mtmt -59.11 -35.58 73.68 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.958 -0.564 . . . . 82.43 111.829 177.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -62.33 -53.27 57.52 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 108.347 -0.982 . . . . 71.83 108.347 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' LEU . . . . . 0.481 HD11 HG23 ' C' ' 20' ' ' ILE . 7.8 mt -47.51 -33.27 6.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.235 0.828 . . . . 62.84 113.235 -178.083 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -27.83 32.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.435 0.531 . . . . 60.04 112.435 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.72 -38.62 75.61 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.839 0.828 . . . . 67.49 110.912 170.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 115.822 -0.626 . . . . 59.12 110.446 175.642 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 3' ' ' LEU . . . . . 0.649 HD13 ' C ' ' E' ' 3' ' ' LEU . 1.9 tm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.472 0.653 . . . . 83.79 112.509 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.53 24.28 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.618 -1.253 . . . . 85.43 107.618 -179.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' ALA . . . . . 0.601 ' HA ' ' HG2' ' E' ' 8' ' ' GLN . . . -60.81 -14.14 19.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.694 0.998 . . . . 90.04 113.694 -175.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 6' ' ' ILE . . . . . 0.484 HG12 ' HB2' ' F' ' 7' ' ' LYS . 13.4 mt -74.37 -49.76 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-N 116.377 -0.374 . . . . 77.44 110.473 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 7' ' ' LYS . . . . . 0.445 ' HE3' HD11 ' E' ' 3' ' ' LEU . 32.1 mttt -57.85 -25.8 61.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.447 -0.797 . . . . 102.62 110.653 175.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' GLN . . . . . 0.601 ' HG2' ' HA ' ' E' ' 5' ' ' ALA . 73.6 mm-40 -61.01 -49.17 78.51 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 107.665 -1.235 . . . . 93.23 107.665 175.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -68.46 -48.61 64.07 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 108.049 -1.093 . . . . 84.63 108.049 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 10' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' E' ' 14' ' ' LYS . 45.7 mt -51.27 -33.69 29.53 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.691 0.757 . . . . 79.44 109.357 178.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.54 -46.01 41.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.191 -0.913 . . . . 58.43 110.103 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.1 -31.9 73.33 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.348 -0.612 . . . . 57.8 109.348 -175.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ILE . . . . . . . . . . . . . 18.0 mt -70.65 -50.56 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 CA-C-N 114.851 -1.068 . . . . 51.8 109.684 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 14' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' E' ' 10' ' ' LEU . 9.7 mttp -62.9 -18.1 62.57 Favored 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 123.562 0.539 . . . . 71.7 109.555 -177.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 15' ' ' LYS . . . . . 0.833 ' HG2' ' O ' ' E' ' 42' ' ' HOH . 68.6 tttt -76.66 -45.89 27.94 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.327 -0.851 . . . . 69.84 109.546 178.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.2 -29.65 70.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.014 -0.539 . . . . 70.27 111.987 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 17' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.41 -42.26 88.05 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.952 -0.699 . . . . 60.02 110.757 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.33 83.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.595 -0.73 . . . . 50.6 109.679 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' ALA . . . . . 0.427 ' HB1' ' HD2' ' F' ' 21' ' ' LYS . . . -63.5 -47.14 82.91 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.179 -0.675 . . . . 52.43 109.179 179.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 20' ' ' ILE . . . . . . . . . . . . . 4.4 mt -57.73 -42.7 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.598 -0.728 . . . . 49.47 110.698 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -60.99 -39.01 88.02 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 119.213 -0.995 . . . . 97.64 113.045 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 23' ' ' GLU . . . . . 0.488 ' O ' HG13 ' E' ' 27' ' ' ILE . 6.6 tp10 -59.41 -43.37 93.02 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.626 0.726 . . . . 53.5 109.57 179.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 24' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.39 -44.28 97.42 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 116.154 -0.475 . . . . 47.27 111.424 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.67 67.16 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.498 0.665 . . . . 47.95 110.898 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.95 -45.11 28.87 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 115.483 -0.781 . . . . 55.4 108.954 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' ILE . . . . . 0.488 HG13 ' O ' ' E' ' 23' ' ' GLU . 13.7 mt -53.66 -47.16 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 114.69 -1.141 . . . . 50.82 109.429 177.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 28' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -63.85 -5.6 4.61 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.556 -0.747 . . . . 82.39 112.883 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 119.517 -0.873 . . . . 90.89 111.291 168.938 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 2' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.317 0.58 . . . . 76.62 111.745 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.8 -41.91 20.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.017 1.117 . . . . 84.1 114.017 178.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.11 -15.84 63.52 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 106.083 -1.821 . . . . 83.22 106.083 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.9 -58.66 6.1 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.07 -1.085 . . . . 75.54 108.07 171.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' ILE . . . . . . . . . . . . . 10.7 mt -56.75 -56.5 13.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 114.845 1.424 . . . . 77.92 114.845 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' LYS . . . . . 0.484 ' HB2' HG12 ' E' ' 6' ' ' ILE . 0.0 OUTLIER -51.12 -34.08 29.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.273 0.558 . . . . 91.71 111.196 -179.184 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 8' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -73.38 -28.81 62.23 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.811 -0.631 . . . . 106.56 111.6 -175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 9' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -75.82 -40.5 54.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.78 -0.646 . . . . 104.01 111.807 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 74.1 mt -58.85 -40.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.805 0.812 . . . . 61.73 109.441 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' ALA . . . . . 0.422 ' O ' ' HD2' ' F' ' 15' ' ' LYS . . . -61.04 -36.6 79.99 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.288 -1.375 . . . . 70.24 107.288 -178.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.46 -38.93 74.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.583 0.706 . . . . 60.02 109.862 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -67.05 -43.28 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.179 -0.919 . . . . 56.28 111.184 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -54.63 -41.43 70.02 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.553 0.692 . . . . 74.77 109.79 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' F' ' 11' ' ' ALA . 0.2 OUTLIER -67.71 -37.17 81.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.803 -0.759 . . . . 83.95 110.469 178.806 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.4 -44.66 95.48 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 119.331 -0.948 . . . . 99.74 108.824 175.054 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' F' ' 17' ' ' LEU . 27.3 mt -63.75 -45.18 91.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.685 -0.806 . . . . 47.96 112.769 -174.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.75 70.07 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 120.427 -0.509 . . . . 51.76 110.736 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.8 -36.33 75.59 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.911 -0.716 . . . . 53.23 110.478 -175.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' ILE . . . . . . . . . . . . . 57.1 mt -59.04 -49.95 81.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-N 115.372 -0.831 . . . . 53.44 110.097 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' LYS . . . . . 0.427 ' HD2' ' HB1' ' E' ' 19' ' ' ALA . 6.7 ttpm? -48.52 -49.16 37.25 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 113.602 0.964 . . . . 62.67 113.602 177.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 22' ' ' PHI . . . . . 0.648 ' I ' ' O ' ' B' ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' GLU . . . . . 0.683 ' O ' HG12 ' F' ' 27' ' ' ILE . 0.0 OUTLIER -61.79 -41.59 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.465 0.913 . . . . 94.95 113.465 175.567 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 24' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.22 -48.29 76.41 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 112.319 0.488 . . . . 46.55 112.319 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.13 -48.48 64.84 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 115.929 -0.578 . . . . 46.99 109.649 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.3 92.88 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.479 -0.782 . . . . 45.53 109.993 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' ILE . . . . . 0.683 HG12 ' O ' ' F' ' 23' ' ' GLU . 15.9 mm -56.83 -50.11 76.34 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.791 -0.641 . . . . 61.67 109.995 174.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 28' ' ' LYS . . . . . 0.459 ' HB2' HG12 ' E' ' 27' ' ' ILE . 14.8 ttpt -61.49 -46.68 88.98 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.794 -0.639 . . . . 64.12 109.88 179.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -49.68 -38.57 33.26 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.453 -0.499 . . . . 81.7 110.672 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.455 0 CA-C-N 115.981 -0.554 . . . . 73.86 113.437 -178.992 . . . . . . . . 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 . . . . . 0.462 ' O ' ' HB3' ' A' ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 45' ' ' HOH . . . . . 0.648 ' O ' ' I ' ' F' ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 35' ' ' HOH . . . . . 0.564 ' O ' ' HA3' ' C' ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 42' ' ' HOH . . . . . 0.833 ' O ' ' HG2' ' E' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 50' ' ' HOH . . . . . 0.527 ' O ' ' N ' ' E' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 113.907 0.323 . . . . 64.61 113.907 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -64.04 -41.02 97.55 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.504 -0.409 . . . . 73.73 109.911 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mp -70.8 -47.69 58.12 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.034 -0.666 . . . . 70.45 111.933 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.09 -47.1 68.81 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.756 0.789 . . . . 65.86 109.868 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -49.64 -48.1 49.44 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.413 -0.812 . . . . 52.62 109.997 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 41.1 mt -64.34 -47.39 89.83 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 CA-C-N 115.69 -0.687 . . . . 58.71 110.722 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.591 ' HD3' ' HB1' ' D' ' 5' ' ' ALA . 26.7 ttpt -53.36 -45.23 69.11 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.613 -1.255 . . . . 73.63 107.613 176.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.4 -47.09 87.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.213 -0.903 . . . . 71.24 111.716 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.94 -39.72 75.04 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 123.422 0.451 . . . . 84.95 110.832 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.31 -38.34 87.5 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.813 -0.755 . . . . 51.02 111.621 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.03 90.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.796 -0.816 . . . . 52.35 108.796 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 36' ' ' HOH . . . -56.07 -53.01 62.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.802 -0.635 . . . . 52.54 111.129 -179.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.2 mt -54.93 -36.08 36.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 112.464 0.542 . . . . 48.27 112.464 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.1 ttpt -59.09 -53.82 54.06 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.684 0.754 . . . . 74.33 111.119 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 18' ' ' ALA . 46.1 mttp -62.23 -35.52 79.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.689 -0.687 . . . . 105.7 111.487 -175.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -62.78 -48.28 79.83 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.451 -0.795 . . . . 99.23 110.431 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 77.0 mt -54.38 -40.55 68.28 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 120.154 -0.618 . . . . 50.24 110.728 172.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 15' ' ' LYS . . . -55.76 -56.74 16.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.422 0.63 . . . . 57.04 111.094 177.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.19 -47.57 45.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.595 0.712 . . . . 59.89 111.627 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.8 mt -58.68 -37.93 68.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 122.096 0.95 . . . . 57.64 111.191 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -61.49 -57.3 12.72 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.852 -1.067 . . . . 62.86 109.941 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.8 -24.6 66.95 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.121 0.873 . . . . 81.51 112.68 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.32 -29.03 42.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.288 0.847 . . . . 56.91 113.288 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.74 -33.42 46.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.384 -0.598 . . . . 53.45 109.384 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.79 62.8 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.489 -0.778 . . . . 59.84 110.084 173.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.688 HD13 HG21 ' B' ' 27' ' ' ILE . 8.9 mt -68.38 -35.68 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 N-CA-C 112.628 0.603 . . . . 60.54 112.628 -175.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -51.72 -27.65 12.55 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 109.281 -0.637 . . . . 78.16 109.281 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 105.422 -2.066 . . . . 84.82 105.422 -171.799 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.699 . . . . . . . . 71.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -83.25 162.26 40.09 Favored Glycine 0 C--N 1.331 0.3 0 N-CA-C 110.264 -1.134 . . . . 60.34 110.264 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -82.62 -43.87 16.47 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 119.458 -0.897 . . . . 63.88 110.873 173.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.57 -48.51 79.15 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.982 -1.859 . . . . 56.83 105.982 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.58 -53.04 42.34 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.125 -0.943 . . . . 57.97 112.831 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.74 -35.23 68.34 Favored 'General case' 0 C--O 1.244 0.81 0 CA-C-O 121.071 0.462 . . . . 59.89 111.406 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 48.4 mt -62.37 -55.69 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.541 -0.754 . . . . 54.61 110.144 176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -52.56 -29.04 23.45 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.796 0.665 . . . . 54.46 112.796 174.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -73.72 -39.54 64.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.855 -0.738 . . . . 87.48 109.669 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLU . . . . . 0.425 ' OE2' ' HA ' ' B' ' 9' ' ' GLU . 1.7 mm-40 -64.66 -37.96 89.35 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.621 0.576 . . . . 86.01 111.63 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.68 -51.74 66.04 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.988 -0.551 . . . . 48.84 110.42 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.417 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . . . -54.3 -40.66 68.11 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.049 -0.523 . . . . 51.14 109.774 176.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.34 98.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.316 0.579 . . . . 51.31 111.404 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 58.0 mt -62.46 -53.38 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.678 -0.692 . . . . 45.39 110.041 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' B' ' 11' ' ' ALA . 28.5 mtmt -51.34 -28.06 11.31 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.293 0.568 . . . . 74.23 109.894 176.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -76.07 -35.21 59.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.737 1.384 . . . . 71.41 114.737 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -70.18 -42.69 72.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 118.276 -1.37 . . . . 70.91 109.217 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mt -49.13 -51.44 32.09 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.954 0.724 . . . . 53.66 112.954 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.57 -50.4 53.73 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.139 -0.482 . . . . 53.4 111.872 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' B' ' 22' ' ' PHI . . . -57.22 -51.04 70.93 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.336 -0.616 . . . . 54.56 109.336 178.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 10.3 mt -54.65 -53.49 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 N-CA-C 113.375 0.879 . . . . 50.37 113.375 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -55.8 -25.43 41.46 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.101 0.778 . . . . 86.19 113.101 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PHI . . . . . 0.427 ' HB2' ' O ' ' B' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.34 -33.84 68.15 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 111.363 0.135 . . . . 69.11 111.363 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.25 -49.09 37.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.489 0.662 . . . . 50.03 110.202 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.29 -42.98 70.67 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.031 -0.986 . . . . 50.8 109.649 173.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.5 -56.86 15.46 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.05 -0.523 . . . . 59.23 110.665 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.688 HG21 HD13 ' A' ' 27' ' ' ILE . 6.6 mt -49.16 -44.57 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 CA-C-N 115.833 -0.621 . . . . 58.91 112.632 -177.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -82.26 4.58 23.08 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 118.463 -1.295 . . . . 61.61 111.011 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -98.02 6.97 47.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.654 0.983 . . . . 69.42 113.654 166.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.518 0 C-N-CA 121.072 -0.585 . . . . 81.22 112.152 179.82 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 120.978 0.21 . . . . 57.68 112.756 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.75 -50.47 29.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.34 0.59 . . . . 61.89 110.439 -179.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' LEU . . . . . . . . . . . . . 31.9 mt -64.98 -54.59 28.01 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.562 0.949 . . . . 68.99 113.562 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.4 -27.45 56.42 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.08 -0.964 . . . . 62.36 111.923 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.36 -26.19 35.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.518 0.675 . . . . 61.12 112.017 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -50.91 -53.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 113.457 0.91 . . . . 52.77 113.457 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.4 -43.05 54.46 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.586 -0.894 . . . . 64.0 108.586 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -45.86 79.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.549 -0.296 . . . . 84.08 110.263 179.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLU . . . . . 0.5 ' OE1' ' NZ ' ' D' ' 14' ' ' LYS . 3.3 mt-10 -57.42 -43.31 83.68 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.517 -0.473 . . . . 81.83 112.214 -178.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 61.2 mt -64.29 -50.28 68.49 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.452 0.644 . . . . 51.42 112.007 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.13 -44.62 52.44 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 56.56 112.056 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.35 -44.51 92.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.02 0.438 . . . . 50.84 110.285 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ILE . . . . . . . . . . . . . 45.4 mt -61.19 -45.95 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 43.87 110.723 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LYS . . . . . 0.609 ' HD3' ' C ' ' C' ' 14' ' ' LYS . 8.5 tmtt? -52.51 -48.59 65.93 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 124.407 1.067 . . . . 71.88 110.464 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . 0.461 ' HE2' ' HB3' ' C' ' 15' ' ' LYS . 3.8 mtpt -61.64 -28.94 69.74 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 119.832 -0.747 . . . . 72.62 109.608 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' GLU . . . . . 0.565 ' HG2' HD13 ' D' ' 17' ' ' LEU . 0.6 OUTLIER -76.23 -39.2 55.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.821 0.82 . . . . 92.14 109.844 -174.263 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 66.9 mt -68.53 -40.92 80.55 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.527 -0.76 . . . . 49.97 109.894 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.81 96.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.384 0.611 . . . . 58.21 109.878 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' C' ' 23' ' ' GLU . . . -52.18 -53.97 36.64 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.613 -0.721 . . . . 60.13 109.292 174.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ILE . . . . . 0.588 ' O ' ' HB2' ' C' ' 23' ' ' GLU . 81.6 mt -59.22 -36.32 62.54 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 N-CA-C 113.041 0.756 . . . . 54.4 113.041 -179.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.424 ' O ' ' HG2' ' C' ' 21' ' ' LYS . 20.6 ttpt -66.42 -32.08 73.24 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.516 1.302 . . . . 68.22 114.516 176.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLU . . . . . 0.588 ' HB2' ' O ' ' C' ' 20' ' ' ILE . 8.4 mm-40 -63.36 -50.92 68.05 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.037 -1.438 . . . . 84.56 111.159 179.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.87 -41.27 83.09 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.147 -0.933 . . . . 69.05 110.807 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ALA . . . . . 0.467 ' O ' ' HB3' ' C' ' 28' ' ' LYS . . . -56.76 -40.11 75.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.825 -0.805 . . . . 72.81 108.825 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.86 -57.5 9.66 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 112.525 0.565 . . . . 70.47 112.525 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mp -54.12 -31.35 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.885 -0.598 . . . . 70.66 109.663 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' C' ' 25' ' ' ALA . 29.3 ttpt -55.63 -25.04 36.86 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.388 -0.597 . . . . 70.79 109.388 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.48 9.69 28.26 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 116.302 1.964 . . . . 97.67 116.302 -177.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' GLY . . . . . 0.564 ' HA3' ' O ' ' C' ' 35' ' ' HOH . . . . . . . . 0 CA--C 1.524 0.637 0 O-C-N 121.448 -0.783 . . . . 87.9 113.9 171.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 108.581 -1.808 . . . . 66.17 108.581 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.86 -38.46 91.05 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.036 -0.728 . . . . 91.3 109.036 170.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 14.1 tp -59.02 -37.31 76.64 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 124.107 0.879 . . . . 63.86 110.597 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.59 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.402 -0.817 . . . . 62.7 110.308 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ALA . . . . . 0.591 ' HB1' ' HD3' ' A' ' 7' ' ' LYS . . . -56.82 -50.28 72.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 124.04 0.838 . . . . 59.59 108.925 179.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.64 -54.85 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.918 -1.037 . . . . 53.48 113.661 173.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 32.5 mttm -56.33 -30.51 62.7 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.959 0.885 . . . . 75.08 111.532 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -74.24 -40.69 62.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.134 -1.393 . . . . 93.24 109.319 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -59.26 -48.09 82.93 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.188 -0.46 . . . . 77.2 112.175 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' D' ' 10' ' ' LEU . 28.1 mt -56.23 -37.76 70.15 Favored 'General case' 0 CA--C 1.504 -0.816 0 O-C-N 121.782 -0.574 . . . . 52.14 110.708 178.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.59 -50.82 65.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 53.26 110.27 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ALA . . . . . 0.7 ' HA ' ' HE3' ' D' ' 15' ' ' LYS . . . -52.41 -42.34 63.98 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.456 0.646 . . . . 53.29 111.389 176.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.41 -45.01 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-N 115.704 -0.68 . . . . 46.13 110.886 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' LYS . . . . . 0.5 ' NZ ' ' OE1' ' C' ' 9' ' ' GLU . 44.5 mtmt -63.49 -30.63 71.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.125 -1.03 . . . . 64.57 109.751 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LYS . . . . . 0.7 ' HE3' ' HA ' ' D' ' 12' ' ' ALA . 2.3 mtmt -57.14 -65.96 0.53 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 119.577 -0.849 . . . . 81.16 112.028 168.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -49.63 -37.03 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.039 0.755 . . . . 74.26 113.039 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . 0.565 HD13 ' HG2' ' C' ' 16' ' ' GLU . 16.0 mt -65.61 -37.06 85.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 119.071 -1.051 . . . . 53.24 110.521 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -46.57 78.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.018 -0.734 . . . . 59.52 109.018 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.11 75.05 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.384 1.253 . . . . 52.25 114.384 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 14.5 mt -66.21 -47.23 85.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 120.775 -0.37 . . . . 52.17 110.546 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' D' ' 17' ' ' LEU . 40.3 mtmt -59.11 -35.58 73.68 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.958 -0.564 . . . . 82.43 111.829 177.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -62.33 -53.27 57.52 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 108.347 -0.982 . . . . 71.83 108.347 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' LEU . . . . . 0.481 HD11 HG23 ' C' ' 20' ' ' ILE . 7.8 mt -47.51 -33.27 6.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.235 0.828 . . . . 62.84 113.235 -178.083 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -27.83 32.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.435 0.531 . . . . 60.04 112.435 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.72 -38.62 75.61 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.839 0.828 . . . . 67.49 110.912 170.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 115.822 -0.626 . . . . 59.12 110.446 175.642 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' LEU . . . . . 0.649 HD13 ' C ' ' E' ' 3' ' ' LEU . 1.9 tm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.472 0.653 . . . . 83.79 112.509 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.53 24.28 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.618 -1.253 . . . . 85.43 107.618 -179.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' ALA . . . . . 0.601 ' HA ' ' HG2' ' E' ' 8' ' ' GLN . . . -60.81 -14.14 19.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.694 0.998 . . . . 90.04 113.694 -175.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' ILE . . . . . 0.484 HG12 ' HB2' ' F' ' 7' ' ' LYS . 13.4 mt -74.37 -49.76 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-N 116.377 -0.374 . . . . 77.44 110.473 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' LYS . . . . . 0.445 ' HE3' HD11 ' E' ' 3' ' ' LEU . 32.1 mttt -57.85 -25.8 61.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.447 -0.797 . . . . 102.62 110.653 175.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' GLN . . . . . 0.601 ' HG2' ' HA ' ' E' ' 5' ' ' ALA . 73.6 mm-40 -61.01 -49.17 78.51 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 107.665 -1.235 . . . . 93.23 107.665 175.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -68.46 -48.61 64.07 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 108.049 -1.093 . . . . 84.63 108.049 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' E' ' 14' ' ' LYS . 45.7 mt -51.27 -33.69 29.53 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.691 0.757 . . . . 79.44 109.357 178.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.54 -46.01 41.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.191 -0.913 . . . . 58.43 110.103 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.1 -31.9 73.33 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.348 -0.612 . . . . 57.8 109.348 -175.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ILE . . . . . . . . . . . . . 18.0 mt -70.65 -50.56 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 CA-C-N 114.851 -1.068 . . . . 51.8 109.684 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' E' ' 10' ' ' LEU . 9.7 mttp -62.9 -18.1 62.57 Favored 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 123.562 0.539 . . . . 71.7 109.555 -177.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' LYS . . . . . 0.833 ' HG2' ' O ' ' E' ' 42' ' ' HOH . 68.6 tttt -76.66 -45.89 27.94 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.327 -0.851 . . . . 69.84 109.546 178.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.2 -29.65 70.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.014 -0.539 . . . . 70.27 111.987 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.41 -42.26 88.05 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.952 -0.699 . . . . 60.02 110.757 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.33 83.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.595 -0.73 . . . . 50.6 109.679 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' ALA . . . . . 0.427 ' HB1' ' HD2' ' F' ' 21' ' ' LYS . . . -63.5 -47.14 82.91 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.179 -0.675 . . . . 52.43 109.179 179.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' ILE . . . . . . . . . . . . . 4.4 mt -57.73 -42.7 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 115.598 -0.728 . . . . 49.47 110.698 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -60.99 -39.01 88.02 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 119.213 -0.995 . . . . 97.64 113.045 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' GLU . . . . . 0.488 ' O ' HG13 ' E' ' 27' ' ' ILE . 6.6 tp10 -59.41 -43.37 93.02 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.626 0.726 . . . . 53.5 109.57 179.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.39 -44.28 97.42 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 116.154 -0.475 . . . . 47.27 111.424 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.67 67.16 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.498 0.665 . . . . 47.95 110.898 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.95 -45.11 28.87 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 115.483 -0.781 . . . . 55.4 108.954 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' ILE . . . . . 0.488 HG13 ' O ' ' E' ' 23' ' ' GLU . 13.7 mt -53.66 -47.16 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 114.69 -1.141 . . . . 50.82 109.429 177.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -63.85 -5.6 4.61 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.556 -0.747 . . . . 82.39 112.883 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 119.517 -0.873 . . . . 90.89 111.291 168.938 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.317 0.58 . . . . 76.62 111.745 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.8 -41.91 20.46 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.017 1.117 . . . . 84.1 114.017 178.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.11 -15.84 63.52 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 106.083 -1.821 . . . . 83.22 106.083 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.9 -58.66 6.1 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.07 -1.085 . . . . 75.54 108.07 171.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' ILE . . . . . . . . . . . . . 10.7 mt -56.75 -56.5 13.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 114.845 1.424 . . . . 77.92 114.845 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' LYS . . . . . 0.484 ' HB2' HG12 ' E' ' 6' ' ' ILE . 0.0 OUTLIER -51.12 -34.08 29.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.273 0.558 . . . . 91.71 111.196 -179.184 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -73.38 -28.81 62.23 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.811 -0.631 . . . . 106.56 111.6 -175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -75.82 -40.5 54.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.78 -0.646 . . . . 104.01 111.807 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 74.1 mt -58.85 -40.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.805 0.812 . . . . 61.73 109.441 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' ALA . . . . . 0.422 ' O ' ' HD2' ' F' ' 15' ' ' LYS . . . -61.04 -36.6 79.99 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.288 -1.375 . . . . 70.24 107.288 -178.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.46 -38.93 74.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.583 0.706 . . . . 60.02 109.862 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -67.05 -43.28 89.0 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-N 115.179 -0.919 . . . . 56.28 111.184 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -54.63 -41.43 70.02 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.553 0.692 . . . . 74.77 109.79 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' F' ' 11' ' ' ALA . 0.2 OUTLIER -67.71 -37.17 81.89 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.803 -0.759 . . . . 83.95 110.469 178.806 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.4 -44.66 95.48 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 119.331 -0.948 . . . . 99.74 108.824 175.054 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' F' ' 17' ' ' LEU . 27.3 mt -63.75 -45.18 91.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.685 -0.806 . . . . 47.96 112.769 -174.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.23 -35.75 70.07 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 120.427 -0.509 . . . . 51.76 110.736 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.8 -36.33 75.59 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 119.911 -0.716 . . . . 53.23 110.478 -175.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' ILE . . . . . . . . . . . . . 57.1 mt -59.04 -49.95 81.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-N 115.372 -0.831 . . . . 53.44 110.097 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' LYS . . . . . 0.427 ' HD2' ' HB1' ' E' ' 19' ' ' ALA . 6.7 ttpm? -48.52 -49.16 37.25 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 113.602 0.964 . . . . 62.67 113.602 177.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' PHI . . . . . 0.648 ' I ' ' O ' ' B' ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' GLU . . . . . 0.683 ' O ' HG12 ' F' ' 27' ' ' ILE . 0.0 OUTLIER -61.79 -41.59 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.465 0.913 . . . . 94.95 113.465 175.567 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.22 -48.29 76.41 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 112.319 0.488 . . . . 46.55 112.319 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.13 -48.48 64.84 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 115.929 -0.578 . . . . 46.99 109.649 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.3 92.88 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.479 -0.782 . . . . 45.53 109.993 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' ILE . . . . . 0.683 HG12 ' O ' ' F' ' 23' ' ' GLU . 15.9 mm -56.83 -50.11 76.34 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.791 -0.641 . . . . 61.67 109.995 174.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' LYS . . . . . 0.459 ' HB2' HG12 ' E' ' 27' ' ' ILE . 14.8 ttpt -61.49 -46.68 88.98 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.794 -0.639 . . . . 64.12 109.88 179.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -49.68 -38.57 33.26 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.453 -0.499 . . . . 81.7 110.672 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.455 0 CA-C-N 115.981 -0.554 . . . . 73.86 113.437 -178.992 . . . . . . . . 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 . . . . . 0.462 ' O ' ' HB3' ' A' ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' HOH . . . . . 0.648 ' O ' ' I ' ' F' ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' HOH . . . . . 0.564 ' O ' ' HA3' ' C' ' 30' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' HOH . . . . . 0.833 ' O ' ' HG2' ' E' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 50' ' ' HOH . . . . . 0.527 ' O ' ' N ' ' E' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_