data_3d3r_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 3d3r _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 ' -6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.091 -1.078 . . . . 42.42 108.091 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -5' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -62.61 -9.85 10.33 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.426 0.898 . . . . 46.49 113.426 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 4.4 mp -78.96 -20.59 48.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 49.65 110.742 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -99.04 112.8 24.83 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.153 -0.619 . . . . 43.35 112.227 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -62.09 -42.28 99.05 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-O 122.673 1.225 . . . . 40.52 109.537 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' GLN . . . . . 0.437 ' NE2' ' N ' ' A' ' 1' ' ' MSE . 2.2 pp0? -151.99 177.82 10.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 103.738 -2.69 . . . . 55.88 103.738 163.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -57.06 -27.31 57.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 117.232 1.653 . . . . 38.37 117.232 -160.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . 0.437 ' N ' ' NE2' ' A' ' -1' ' ' GLN . 39.2 mtp -117.8 23.82 11.44 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.608 -0.936 . . . . 51.87 113.184 -174.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 t -133.99 151.31 51.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.902 -0.571 . . . . 36.49 110.552 -175.901 -152.317 -169.68 -113.159 76.323 20.143 118.987 -129.456 61.549 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.33 128.67 50.35 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 123.626 0.77 . . . . 39.95 110.524 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 47' ' ' ILE . 44.6 t -65.27 133.95 52.57 Favored 'General case' 0 C--O 1.208 -1.095 0 C-N-CA 119.72 -0.792 . . . . 29.81 109.266 175.6 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 85.9 mt -95.46 123.6 55.96 Favored Pre-proline 0 N--CA 1.489 1.49 0 N-CA-C 106.478 -1.675 . . . . 27.95 106.478 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -51.93 128.26 26.11 Favored 'Trans proline' 0 C--O 1.258 1.513 0 O-C-N 123.621 1.327 . . . . 27.0 111.696 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 43.0 m -125.11 131.81 53.22 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.289 -1.004 . . . . 30.36 108.289 -168.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -80.32 134.07 36.02 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 124.157 0.911 . . . . 32.23 110.013 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.5 t -77.96 124.75 36.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.095 0 N-CA-C 106.435 -1.691 . . . . 27.08 106.435 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -117.13 -10.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 113.504 0.928 . . . . 32.27 113.504 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -160.26 146.87 15.76 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.5 -0.926 . . . . 31.72 108.5 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 92.1 t -132.95 128.97 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 108.575 -0.898 . . . . 33.61 108.575 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -128.08 86.44 2.47 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.924 1.345 . . . . 48.77 109.867 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -68.73 -29.66 68.13 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.314 -0.857 . . . . 34.33 112.264 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.32 -35.63 79.81 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 118.438 -1.305 . . . . 45.01 110.736 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -94.75 10.39 35.3 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.003 1.483 . . . . 63.79 115.003 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 41.06 59.96 2.14 Favored 'General case' 0 CA--C 1.49 -1.333 0 C-N-CA 123.611 0.764 . . . . 43.57 110.768 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -141.06 159.75 41.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.618 -0.833 . . . . 40.52 111.281 168.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.08 152.38 32.46 Favored 'Isoleucine or valine' 0 C--O 1.25 1.122 0 N-CA-C 108.506 -0.924 . . . . 35.46 108.506 173.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -109.01 130.33 55.47 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.804 -1.554 . . . . 34.14 106.804 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.5 m -119.71 154.22 22.46 Favored 'Isoleucine or valine' 0 C--O 1.255 1.376 0 C-N-CA 119.418 -0.913 . . . . 33.71 109.706 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -113.65 122.37 46.97 Favored 'General case' 0 C--O 1.263 1.772 0 O-C-N 125.326 1.641 . . . . 48.8 109.353 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.2 m -122.18 111.56 17.11 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 106.309 -1.737 . . . . 33.23 106.309 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 mt 40.38 43.58 1.5 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 124.783 1.302 . . . . 40.55 110.023 -171.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.98 -4.63 78.42 Favored Glycine 0 C--O 1.213 -1.171 0 N-CA-C 114.984 0.754 . . . . 40.23 114.984 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.7 t -100.91 128.28 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 107.329 -1.36 . . . . 35.97 107.329 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -95.48 137.96 33.82 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-N 115.873 -0.603 . . . . 43.02 110.695 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . 0.444 ' NH1' ' O ' ' A' ' 108' ' ' HOH . 13.7 mtm-85 -137.82 135.96 36.73 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 117.937 -1.03 . . . . 47.7 108.859 178.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -96.13 132.09 41.89 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 102.204 -3.258 . . . . 54.14 102.204 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.3 m -135.67 147.08 28.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 C-N-CA 120.565 -0.454 . . . . 37.99 110.411 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 t -59.52 139.91 56.73 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.183 -1.043 . . . . 38.1 108.183 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 95.5 p -102.3 16.65 25.59 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.684 0.624 . . . . 31.48 112.684 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -57.73 -30.43 65.56 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.884 1.809 . . . . 49.43 115.884 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.8 mt -107.8 24.15 13.37 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.719 1.007 . . . . 38.88 113.719 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 3.1 ptt? -67.63 139.62 56.83 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 117.059 -1.857 . . . . 39.96 108.5 169.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.2 p -86.25 -14.39 43.95 Favored 'General case' 0 C--O 1.251 1.174 0 O-C-N 120.43 -1.419 . . . . 38.27 112.646 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -153.96 164.19 21.51 Favored Pre-proline 0 C--O 1.275 2.433 0 N-CA-C 108.755 -0.831 . . . . 41.45 108.755 170.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -61.34 140.55 88.83 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 122.982 0.991 . . . . 30.62 112.152 -177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -113.17 152.85 29.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 121.881 0.848 . . . . 29.68 113.06 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.68 160.08 39.24 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.626 -1.17 . . . . 29.65 112.281 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.6 mt -50.32 131.16 9.98 Favored 'Isoleucine or valine' 0 C--O 1.264 1.86 0 CA-C-O 121.52 0.676 . . . . 39.93 112.207 170.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.8 -10.92 73.44 Favored Glycine 0 C--O 1.22 -0.748 0 N-CA-C 119.969 2.747 . . . . 30.41 119.969 -175.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -67.7 152.4 45.67 Favored 'General case' 0 C--O 1.196 -1.712 0 N-CA-C 106.764 -1.569 . . . . 34.28 106.764 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -110.72 138.69 46.8 Favored 'General case' 0 C--O 1.273 2.306 0 N-CA-C 106.299 -1.741 . . . . 35.9 106.299 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.01 152.06 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-N 114.537 -1.21 . . . . 27.23 112.366 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -103.0 140.33 37.4 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.303 -1.369 . . . . 29.77 107.303 160.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . 0.412 ' O ' ' OG ' ' A' ' 4' ' ' SER . 43.4 mt -123.06 142.43 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 106.713 -1.588 . . . . 36.26 106.713 -171.008 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -145.94 155.23 42.71 Favored 'General case' 0 C--O 1.248 1.022 0 N-CA-C 108.446 -0.946 . . . . 38.32 108.446 173.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.5 mt -76.72 129.19 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 104.599 -2.371 . . . . 40.76 104.599 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.83 -158.63 8.71 Favored Glycine 0 C--O 1.218 -0.906 0 C-N-CA 117.428 -2.32 . . . . 30.59 110.537 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -160.45 172.22 17.63 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 117.957 -1.497 . . . . 40.11 110.01 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.3 m -133.19 165.63 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 105.436 -2.061 . . . . 31.44 105.436 170.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' MSE . . . . . . . . . . . . . 77.3 mtm -111.64 123.72 50.82 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.23 -0.655 . . . . 44.56 109.23 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -107.83 140.87 40.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 O-C-N 123.992 0.807 . . . . 41.49 109.098 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -74.96 147.23 41.04 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 118.346 -1.342 . . . . 52.43 110.094 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 tt -127.91 139.6 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.077 -1.453 . . . . 36.39 107.077 172.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -48.4 131.74 16.83 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 123.239 0.337 . . . . 47.03 111.047 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.22 -43.23 96.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 119.838 -0.745 . . . . 35.32 110.699 -171.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.01 -38.21 90.23 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.093 1.516 . . . . 42.38 115.093 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -66.14 -43.08 88.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.005 -0.998 . . . . 47.44 112.242 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.13 -55.38 31.78 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 122.667 1.222 . . . . 31.16 111.82 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 77.8 mt -59.2 -38.74 80.62 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.564 0.95 . . . . 35.15 113.564 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -66.9 -41.24 87.46 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 119.728 -0.789 . . . . 54.34 111.426 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 94.3 p -73.86 -27.42 61.07 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 121.606 -0.683 . . . . 37.27 112.549 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 mt -60.24 -30.25 69.29 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 114.259 1.207 . . . . 35.16 114.259 -172.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.61 -37.57 84.41 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 118.777 -1.169 . . . . 55.81 111.815 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.88 -38.99 87.35 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.125 0.488 . . . . 41.38 111.905 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -63.22 -45.28 92.38 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-O 121.186 0.517 . . . . 35.14 111.734 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -60.42 -37.73 81.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.293 1.22 . . . . 55.97 114.293 174.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -65.62 -37.46 86.64 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 121.695 -0.628 . . . . 53.26 110.928 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 60.3 mt -62.48 -51.83 67.42 Favored 'Isoleucine or valine' 0 C--O 1.27 2.177 0 N-CA-C 108.528 -0.916 . . . . 35.35 108.528 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.07 -43.72 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 115.776 -0.647 . . . . 43.22 110.808 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -39.09 83.24 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.42 0.45 . . . . 51.56 111.965 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.0 ttmm -74.78 -35.31 62.53 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.402 0.439 . . . . 56.31 111.916 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.4 mt -104.83 -4.15 22.61 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.87 2.544 . . . . 49.05 117.87 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-N 118.559 0.618 . . . . 72.21 109.794 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' -3' ' ' TYR . . . . . . . . . . . . . 13.1 t80 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 114.481 1.289 . . . . 61.58 114.481 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' -2' ' ' PHE . . . . . 0.484 ' CE2' ' CG2' ' B' ' 49' ' ' ILE 0.404 12.9 p90 -68.98 -15.94 63.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 117.015 -1.874 . . . . 48.59 114.897 171.454 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' -1' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -57.6 -26.08 61.0 Favored 'General case' 0 C--O 1.253 1.284 0 N-CA-C 108.886 -0.783 . . . . 44.56 108.886 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' GLY . . . . . . . . . . . . . . . -66.84 -14.19 62.68 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.605 -0.725 . . . . 40.1 113.751 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MSE . . . . . . . . . . . . . 19.0 mtp -89.06 -5.44 57.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 114.665 1.357 . . . . 48.69 114.665 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -149.78 162.79 39.57 Favored 'General case' 0 CA--C 1.497 -1.073 0 C-N-CA 118.78 -1.168 . . . . 37.28 110.077 -177.493 61.549 -129.456 -113.159 118.987 20.143 76.323 -169.68 -152.317 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 12.9 mt -108.26 121.91 45.87 Favored 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 109.008 -0.738 . . . . 39.24 109.008 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 70.9 m -67.98 142.59 55.92 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.277 -1.379 . . . . 33.62 107.277 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 82.4 mt -99.53 127.63 33.72 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 106.251 -1.759 . . . . 30.14 106.251 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -57.65 130.33 38.18 Favored 'Trans proline' 0 C--O 1.251 1.166 0 C-N-CA 116.517 -1.855 . . . . 27.75 111.635 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 33.4 m -128.87 131.73 47.68 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 117.968 -1.015 . . . . 28.95 109.998 -170.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -88.79 137.22 32.51 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.671 0.669 . . . . 38.82 112.199 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.34 115.75 18.42 Favored 'Isoleucine or valine' 0 C--O 1.28 2.696 0 N-CA-C 108.017 -1.105 . . . . 28.36 108.017 170.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 34.8 m -113.62 -8.83 12.21 Favored 'Isoleucine or valine' 0 C--O 1.265 1.883 0 C-N-CA 124.684 1.194 . . . . 31.44 113.626 -171.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.43 152.03 26.97 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.32 -0.992 . . . . 31.36 108.32 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 92.5 t -138.77 123.96 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.239 -1.393 . . . . 34.56 107.239 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -118.96 97.22 5.59 Favored 'General case' 0 C--O 1.212 -0.908 0 N-CA-C 106.891 -1.522 . . . . 52.0 106.891 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -77.66 -12.48 59.97 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.441 0.904 . . . . 37.02 113.441 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -79.92 -36.63 36.09 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.443 -1.303 . . . . 56.14 109.385 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -84.6 -12.98 52.97 Favored 'General case' 0 C--O 1.258 1.505 0 CA-C-O 122.006 0.908 . . . . 67.47 112.101 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 50.05 53.94 11.95 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.901 0.858 . . . . 40.2 111.362 -170.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 80.8 p -132.57 160.18 37.31 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 114.763 -1.108 . . . . 41.71 110.45 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.26 159.1 39.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 CA-C-N 115.112 -0.949 . . . . 35.55 108.528 171.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 25.9 m -111.59 139.54 46.94 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 106.494 -1.669 . . . . 33.13 106.494 170.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 4.8 m -130.63 127.1 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-O 122.772 1.273 . . . . 28.74 109.067 171.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -102.36 128.86 48.76 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 113.553 -1.658 . . . . 48.81 108.736 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 49.6 m -124.31 105.66 9.64 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 104.615 -2.365 . . . . 30.82 104.615 -177.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.6 mt 43.79 44.46 5.66 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 125.65 1.844 . . . . 35.72 112.093 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -11.07 65.65 Favored Glycine 0 N--CA 1.473 1.163 0 N-CA-C 117.085 1.594 . . . . 38.62 117.085 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 76.8 t -104.35 126.94 59.03 Favored 'Isoleucine or valine' 0 C--O 1.253 1.245 0 CA-C-N 118.48 1.14 . . . . 37.86 111.895 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.6 mtt180 -102.98 139.04 39.07 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 114.82 1.415 . . . . 38.22 114.82 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -136.57 141.82 43.34 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 107.984 -1.117 . . . . 42.18 107.984 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -88.59 135.63 33.4 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 123.458 0.474 . . . . 50.35 110.9 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 89.3 t -132.36 143.96 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 N-CA-C 107.914 -1.143 . . . . 37.97 107.914 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 37.7 t -59.02 131.76 52.02 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.427 0.899 . . . . 37.05 113.427 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.0 m -62.34 -20.08 64.01 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 112.795 0.665 . . . . 36.17 112.795 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -69.13 -13.71 62.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 118.772 -1.171 . . . . 54.0 109.794 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.3 mt -86.63 -0.81 56.93 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 113.457 0.91 . . . . 41.69 113.457 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' MSE . . . . . . . . . . . . . 52.3 mtt -67.2 129.31 39.49 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.675 0.67 . . . . 49.38 111.754 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 69.3 p -82.85 -20.99 34.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 118.434 -1.306 . . . . 40.24 110.021 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -148.11 166.04 16.79 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 106.998 -1.482 . . . . 51.63 106.998 172.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -55.41 124.81 17.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.14 1.227 . . . . 37.99 113.037 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 48.3 mt -112.08 149.94 31.41 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.176 -0.465 . . . . 39.64 109.752 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -127.81 165.22 20.54 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 124.008 0.818 . . . . 31.04 111.43 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 5.5 tp -49.17 137.34 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 123.022 0.201 . . . . 31.24 111.132 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.66 -14.36 52.06 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 117.754 1.862 . . . . 30.75 117.754 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -70.26 158.85 35.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.204 1.002 . . . . 37.14 109.62 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -111.44 143.83 41.63 Favored 'General case' 0 C--O 1.27 2.143 0 O-C-N 124.948 1.405 . . . . 31.44 110.149 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.39 157.1 42.19 Favored 'Isoleucine or valine' 0 C--O 1.249 1.041 0 C-N-CA 119.357 -0.937 . . . . 30.58 108.499 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.4 mt -124.52 131.4 53.49 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 102.523 -3.14 . . . . 37.54 102.523 170.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . 0.749 ' CD1' ' CD1' ' B' ' 49' ' ' ILE . 14.3 pt -79.27 159.11 4.58 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 C-N-CA 115.798 -2.361 . . . . 43.11 114.124 173.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -125.18 113.98 18.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 102.218 -3.253 . . . . 46.48 102.218 174.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ILE . . . . . 0.749 ' CD1' ' CD1' ' B' ' 47' ' ' ILE . 1.9 mp -95.26 148.01 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 O-C-N 124.703 1.252 . . . . 43.3 109.627 -177.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.68 -166.14 38.73 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 117.333 -2.365 . . . . 31.07 109.936 175.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -89.61 117.28 28.38 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 119.156 -1.017 . . . . 38.82 109.41 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.06 137.22 21.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.142 0 N-CA-C 103.358 -2.83 . . . . 32.7 103.358 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' MSE . . . . . . . . . . . . . 69.6 mtm -124.22 124.37 42.3 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.088 1.313 . . . . 46.0 110.564 -178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -112.67 124.75 53.27 Favored 'General case' 0 N--CA 1.442 -0.849 0 O-C-N 124.062 0.851 . . . . 41.35 110.289 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -76.6 139.2 40.55 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 105.775 -1.935 . . . . 47.26 105.775 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 42.6 pt -128.1 162.88 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 108.446 -0.946 . . . . 35.15 108.446 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.03 133.27 55.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.561 -0.533 . . . . 44.78 109.561 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 ttp180 -51.82 -48.76 63.77 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.075 -0.511 . . . . 49.06 111.679 -174.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -67.31 -41.67 84.97 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.252 0.549 . . . . 41.73 111.54 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -59.68 -46.07 90.17 Favored 'General case' 0 C--O 1.26 1.654 0 C-N-CA 119.155 -1.018 . . . . 48.0 112.36 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.76 76.45 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 107.519 -1.289 . . . . 29.64 107.519 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.83 -39.9 91.29 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.571 0.952 . . . . 36.23 113.571 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -66.18 -46.3 77.82 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 123.277 0.361 . . . . 48.23 111.32 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 55.9 p -60.32 -36.1 77.15 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.307 0.855 . . . . 30.9 113.307 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.3 mt -59.84 -26.05 65.5 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 115.034 1.494 . . . . 32.47 115.034 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -58.41 -40.13 81.61 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.567 0.951 . . . . 56.6 113.567 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 86.1 mt -69.14 -46.26 68.07 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.061 0.945 . . . . 41.97 108.67 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -55.94 -45.99 78.63 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 116.685 -2.006 . . . . 33.17 113.638 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLN . . . . . 0.656 ' NE2' ' O ' ' B' ' 99' ' ' HOH . 2.5 mm100 -53.61 -43.05 68.33 Favored 'General case' 0 C--O 1.25 1.085 0 CA-C-O 121.296 0.569 . . . . 44.68 111.532 178.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.16 -43.96 90.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 59.83 111.119 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 84.5 mt -62.39 -44.81 99.62 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 118.614 0.643 . . . . 38.31 109.721 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.9 -43.74 97.88 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 C-N-CA 120.41 -0.516 . . . . 43.89 110.988 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -60.12 -27.81 67.35 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 53.01 111.322 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -90.72 -45.54 8.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.014 -0.539 . . . . 59.35 111.88 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 7.9 mt -78.91 -64.52 1.16 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 119.318 -0.953 . . . . 65.47 111.318 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.774 0.43 . . . . 76.09 111.872 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . 0.444 ' O ' ' NH1' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' HOH . . . . . 0.656 ' O ' ' NE2' ' B' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.091 -1.078 . . . . 42.42 108.091 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -5' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -62.61 -9.85 10.33 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.426 0.898 . . . . 46.49 113.426 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 4.4 mp -78.96 -20.59 48.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 49.65 110.742 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -99.04 112.8 24.83 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.153 -0.619 . . . . 43.35 112.227 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -62.09 -42.28 99.05 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-O 122.673 1.225 . . . . 40.52 109.537 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.99 177.82 10.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 103.738 -2.69 . . . . 55.88 103.738 163.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -57.06 -27.31 57.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 117.232 1.653 . . . . 38.37 117.232 -160.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 39.2 mtp -117.8 23.82 11.44 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.608 -0.936 . . . . 51.87 113.184 -174.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 t -133.99 151.31 51.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.902 -0.571 . . . . 36.49 110.552 -175.901 -152.317 -169.68 -113.159 76.323 20.143 118.987 -129.456 61.549 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.33 128.67 50.35 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 123.626 0.77 . . . . 39.95 110.524 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.6 t -65.27 133.95 52.57 Favored 'General case' 0 C--O 1.208 -1.095 0 C-N-CA 119.72 -0.792 . . . . 29.81 109.266 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 85.9 mt -95.46 123.6 55.96 Favored Pre-proline 0 N--CA 1.489 1.49 0 N-CA-C 106.478 -1.675 . . . . 27.95 106.478 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -51.93 128.26 26.11 Favored 'Trans proline' 0 C--O 1.258 1.513 0 O-C-N 123.621 1.327 . . . . 27.0 111.696 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 43.0 m -125.11 131.81 53.22 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.289 -1.004 . . . . 30.36 108.289 -168.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -80.32 134.07 36.02 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 124.157 0.911 . . . . 32.23 110.013 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.5 t -77.96 124.75 36.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.095 0 N-CA-C 106.435 -1.691 . . . . 27.08 106.435 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -117.13 -10.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 113.504 0.928 . . . . 32.27 113.504 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -160.26 146.87 15.76 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.5 -0.926 . . . . 31.72 108.5 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 92.1 t -132.95 128.97 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 108.575 -0.898 . . . . 33.61 108.575 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -128.08 86.44 2.47 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.924 1.345 . . . . 48.77 109.867 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -68.73 -29.66 68.13 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.314 -0.857 . . . . 34.33 112.264 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.32 -35.63 79.81 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 118.438 -1.305 . . . . 45.01 110.736 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -94.75 10.39 35.3 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.003 1.483 . . . . 63.79 115.003 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 41.06 59.96 2.14 Favored 'General case' 0 CA--C 1.49 -1.333 0 C-N-CA 123.611 0.764 . . . . 43.57 110.768 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -141.06 159.75 41.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.618 -0.833 . . . . 40.52 111.281 168.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.08 152.38 32.46 Favored 'Isoleucine or valine' 0 C--O 1.25 1.122 0 N-CA-C 108.506 -0.924 . . . . 35.46 108.506 173.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -109.01 130.33 55.47 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.804 -1.554 . . . . 34.14 106.804 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.5 m -119.71 154.22 22.46 Favored 'Isoleucine or valine' 0 C--O 1.255 1.376 0 C-N-CA 119.418 -0.913 . . . . 33.71 109.706 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -113.65 122.37 46.97 Favored 'General case' 0 C--O 1.263 1.772 0 O-C-N 125.326 1.641 . . . . 48.8 109.353 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.2 m -122.18 111.56 17.11 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 106.309 -1.737 . . . . 33.23 106.309 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 mt 40.38 43.58 1.5 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 124.783 1.302 . . . . 40.55 110.023 -171.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.98 -4.63 78.42 Favored Glycine 0 C--O 1.213 -1.171 0 N-CA-C 114.984 0.754 . . . . 40.23 114.984 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.7 t -100.91 128.28 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 107.329 -1.36 . . . . 35.97 107.329 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -95.48 137.96 33.82 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-N 115.873 -0.603 . . . . 43.02 110.695 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mtm-85 -137.82 135.96 36.73 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 117.937 -1.03 . . . . 47.7 108.859 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -96.13 132.09 41.89 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 102.204 -3.258 . . . . 54.14 102.204 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.3 m -135.67 147.08 28.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 C-N-CA 120.565 -0.454 . . . . 37.99 110.411 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 t -59.52 139.91 56.73 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.183 -1.043 . . . . 38.1 108.183 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 95.5 p -102.3 16.65 25.59 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.684 0.624 . . . . 31.48 112.684 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -57.73 -30.43 65.56 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.884 1.809 . . . . 49.43 115.884 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.8 mt -107.8 24.15 13.37 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.719 1.007 . . . . 38.88 113.719 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 3.1 ptt? -67.63 139.62 56.83 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 117.059 -1.857 . . . . 39.96 108.5 169.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.2 p -86.25 -14.39 43.95 Favored 'General case' 0 C--O 1.251 1.174 0 O-C-N 120.43 -1.419 . . . . 38.27 112.646 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -153.96 164.19 21.51 Favored Pre-proline 0 C--O 1.275 2.433 0 N-CA-C 108.755 -0.831 . . . . 41.45 108.755 170.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -61.34 140.55 88.83 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 122.982 0.991 . . . . 30.62 112.152 -177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -113.17 152.85 29.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 121.881 0.848 . . . . 29.68 113.06 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.68 160.08 39.24 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.626 -1.17 . . . . 29.65 112.281 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.6 mt -50.32 131.16 9.98 Favored 'Isoleucine or valine' 0 C--O 1.264 1.86 0 CA-C-O 121.52 0.676 . . . . 39.93 112.207 170.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.8 -10.92 73.44 Favored Glycine 0 C--O 1.22 -0.748 0 N-CA-C 119.969 2.747 . . . . 30.41 119.969 -175.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -67.7 152.4 45.67 Favored 'General case' 0 C--O 1.196 -1.712 0 N-CA-C 106.764 -1.569 . . . . 34.28 106.764 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -110.72 138.69 46.8 Favored 'General case' 0 C--O 1.273 2.306 0 N-CA-C 106.299 -1.741 . . . . 35.9 106.299 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.01 152.06 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-N 114.537 -1.21 . . . . 27.23 112.366 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -103.0 140.33 37.4 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.303 -1.369 . . . . 29.77 107.303 160.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.685 HG12 ' HG2' ' B' ' 53' ' ' MSE . 43.4 mt -123.06 142.43 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 106.713 -1.588 . . . . 36.26 106.713 -171.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -145.94 155.23 42.71 Favored 'General case' 0 C--O 1.248 1.022 0 N-CA-C 108.446 -0.946 . . . . 38.32 108.446 173.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.5 mt -76.72 129.19 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 104.599 -2.371 . . . . 40.76 104.599 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.83 -158.63 8.71 Favored Glycine 0 C--O 1.218 -0.906 0 C-N-CA 117.428 -2.32 . . . . 30.59 110.537 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -160.45 172.22 17.63 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 117.957 -1.497 . . . . 40.11 110.01 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.3 m -133.19 165.63 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 105.436 -2.061 . . . . 31.44 105.436 170.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' MSE . . . . . . . . . . . . . 77.3 mtm -111.64 123.72 50.82 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.23 -0.655 . . . . 44.56 109.23 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -107.83 140.87 40.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 O-C-N 123.992 0.807 . . . . 41.49 109.098 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -74.96 147.23 41.04 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 118.346 -1.342 . . . . 52.43 110.094 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 tt -127.91 139.6 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.077 -1.453 . . . . 36.39 107.077 172.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -48.4 131.74 16.83 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 123.239 0.337 . . . . 47.03 111.047 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . 0.515 HH21 ' HG2' ' A' ' 58' ' ' ARG . 3.7 ttm180 -60.22 -43.23 96.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 119.838 -0.745 . . . . 36.93 110.699 -171.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.01 -38.21 90.23 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.093 1.516 . . . . 42.38 115.093 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -66.14 -43.08 88.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.005 -0.998 . . . . 47.44 112.242 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.13 -55.38 31.78 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 122.667 1.222 . . . . 31.16 111.82 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 77.8 mt -59.2 -38.74 80.62 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.564 0.95 . . . . 35.15 113.564 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -66.9 -41.24 87.46 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 119.728 -0.789 . . . . 54.34 111.426 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 94.3 p -73.86 -27.42 61.07 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 121.606 -0.683 . . . . 37.27 112.549 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 mt -60.24 -30.25 69.29 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 114.259 1.207 . . . . 35.16 114.259 -172.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.61 -37.57 84.41 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 118.777 -1.169 . . . . 55.81 111.815 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.88 -38.99 87.35 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.125 0.488 . . . . 41.38 111.905 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -63.22 -45.28 92.38 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-O 121.186 0.517 . . . . 35.14 111.734 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -60.42 -37.73 81.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.293 1.22 . . . . 55.97 114.293 174.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -65.62 -37.46 86.64 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 121.695 -0.628 . . . . 53.26 110.928 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 60.3 mt -62.48 -51.83 67.42 Favored 'Isoleucine or valine' 0 C--O 1.27 2.177 0 N-CA-C 108.528 -0.916 . . . . 35.35 108.528 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.07 -43.72 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 115.776 -0.647 . . . . 43.22 110.808 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -39.09 83.24 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.42 0.45 . . . . 51.56 111.965 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.0 ttmm -74.78 -35.31 62.53 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.402 0.439 . . . . 56.31 111.916 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.4 mt -104.83 -4.15 22.61 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.87 2.544 . . . . 49.05 117.87 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-N 118.559 0.618 . . . . 72.21 109.794 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' -3' ' ' TYR . . . . . 0.444 ' HD2' ' O ' ' B' ' 115' ' ' HOH . 13.1 t80 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 114.481 1.289 . . . . 61.58 114.481 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' -2' ' ' PHE . . . . . 0.629 ' CE2' HG22 ' B' ' 49' ' ' ILE 0.404 12.9 p90 -68.98 -15.94 63.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 117.015 -1.874 . . . . 48.59 114.897 171.454 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' -1' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -57.6 -26.08 61.0 Favored 'General case' 0 C--O 1.253 1.284 0 N-CA-C 108.886 -0.783 . . . . 44.56 108.886 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 0' ' ' GLY . . . . . . . . . . . . . . . -66.84 -14.19 62.68 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.605 -0.725 . . . . 40.1 113.751 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MSE . . . . . . . . . . . . . 19.0 mtp -89.06 -5.44 57.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 114.665 1.357 . . . . 48.69 114.665 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -149.78 162.79 39.57 Favored 'General case' 0 CA--C 1.497 -1.073 0 C-N-CA 118.78 -1.168 . . . . 37.28 110.077 -177.493 61.549 -129.456 -113.159 118.987 20.143 76.323 -169.68 -152.317 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 12.9 mt -108.26 121.91 45.87 Favored 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 109.008 -0.738 . . . . 39.24 109.008 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 70.9 m -67.98 142.59 55.92 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.277 -1.379 . . . . 33.62 107.277 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 82.4 mt -99.53 127.63 33.72 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 106.251 -1.759 . . . . 30.14 106.251 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -57.65 130.33 38.18 Favored 'Trans proline' 0 C--O 1.251 1.166 0 C-N-CA 116.517 -1.855 . . . . 27.75 111.635 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' SER . . . . . 0.576 ' HB3' HG12 ' B' ' 21' ' ' VAL . 33.4 m -128.87 131.73 47.68 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 117.968 -1.015 . . . . 28.95 109.998 -170.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -88.79 137.22 32.51 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.671 0.669 . . . . 38.82 112.199 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.34 115.75 18.42 Favored 'Isoleucine or valine' 0 C--O 1.28 2.696 0 N-CA-C 108.017 -1.105 . . . . 28.36 108.017 170.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 34.8 m -113.62 -8.83 12.21 Favored 'Isoleucine or valine' 0 C--O 1.265 1.883 0 C-N-CA 124.684 1.194 . . . . 31.44 113.626 -171.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.43 152.03 26.97 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.32 -0.992 . . . . 31.36 108.32 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 92.5 t -138.77 123.96 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.239 -1.393 . . . . 34.56 107.239 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -118.96 97.22 5.59 Favored 'General case' 0 C--O 1.212 -0.908 0 N-CA-C 106.891 -1.522 . . . . 52.0 106.891 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -77.66 -12.48 59.97 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.441 0.904 . . . . 37.02 113.441 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -79.92 -36.63 36.09 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.443 -1.303 . . . . 56.14 109.385 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -84.6 -12.98 52.97 Favored 'General case' 0 C--O 1.258 1.505 0 CA-C-O 122.006 0.908 . . . . 67.47 112.101 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 50.05 53.94 11.95 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.901 0.858 . . . . 40.2 111.362 -170.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 80.8 p -132.57 160.18 37.31 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 114.763 -1.108 . . . . 41.71 110.45 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.26 159.1 39.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 CA-C-N 115.112 -0.949 . . . . 35.55 108.528 171.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 25.9 m -111.59 139.54 46.94 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 106.494 -1.669 . . . . 33.13 106.494 170.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . 0.576 HG12 ' HB3' ' B' ' 7' ' ' SER . 4.8 m -130.63 127.1 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-O 122.772 1.273 . . . . 30.24 109.067 171.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -102.36 128.86 48.76 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 113.553 -1.658 . . . . 48.81 108.736 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 49.6 m -124.31 105.66 9.64 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 104.615 -2.365 . . . . 30.82 104.615 -177.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.6 mt 43.79 44.46 5.66 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 125.65 1.844 . . . . 35.72 112.093 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -11.07 65.65 Favored Glycine 0 N--CA 1.473 1.163 0 N-CA-C 117.085 1.594 . . . . 38.62 117.085 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 76.8 t -104.35 126.94 59.03 Favored 'Isoleucine or valine' 0 C--O 1.253 1.245 0 CA-C-N 118.48 1.14 . . . . 37.86 111.895 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.6 mtt180 -102.98 139.04 39.07 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 114.82 1.415 . . . . 38.22 114.82 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -136.57 141.82 43.34 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 107.984 -1.117 . . . . 42.18 107.984 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -88.59 135.63 33.4 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 123.458 0.474 . . . . 50.35 110.9 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 89.3 t -132.36 143.96 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 N-CA-C 107.914 -1.143 . . . . 37.97 107.914 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 37.7 t -59.02 131.76 52.02 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.427 0.899 . . . . 37.05 113.427 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.0 m -62.34 -20.08 64.01 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 112.795 0.665 . . . . 36.17 112.795 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -69.13 -13.71 62.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 118.772 -1.171 . . . . 54.0 109.794 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.3 mt -86.63 -0.81 56.93 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 113.457 0.91 . . . . 41.69 113.457 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' MSE . . . . . 0.508 ' HG2' HD12 ' B' ' 39' ' ' LEU . 52.3 mtt -67.2 129.31 39.49 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.675 0.67 . . . . 49.38 111.754 172.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 69.3 p -82.85 -20.99 34.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 118.434 -1.306 . . . . 40.24 110.021 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLU . . . . . 0.488 ' HB2' ' HD2' ' B' ' 38' ' ' PRO . 11.9 pt-20 -148.11 166.04 16.79 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 106.998 -1.482 . . . . 51.63 106.998 172.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PRO . . . . . 0.488 ' HD2' ' HB2' ' B' ' 37' ' ' GLU . 1.5 Cg_endo -55.41 124.81 17.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.14 1.227 . . . . 37.99 113.037 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . 0.508 HD12 ' HG2' ' B' ' 35' ' ' MSE . 48.3 mt -112.08 149.94 31.41 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.176 -0.465 . . . . 39.64 109.752 174.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -127.81 165.22 20.54 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 124.008 0.818 . . . . 31.04 111.43 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 5.5 tp -49.17 137.34 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 123.022 0.201 . . . . 31.24 111.132 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.66 -14.36 52.06 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 117.754 1.862 . . . . 30.75 117.754 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -70.26 158.85 35.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.204 1.002 . . . . 37.14 109.62 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -111.44 143.83 41.63 Favored 'General case' 0 C--O 1.27 2.143 0 O-C-N 124.948 1.405 . . . . 31.44 110.149 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.39 157.1 42.19 Favored 'Isoleucine or valine' 0 C--O 1.249 1.041 0 C-N-CA 119.357 -0.937 . . . . 30.58 108.499 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.4 mt -124.52 131.4 53.49 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 102.523 -3.14 . . . . 37.54 102.523 170.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . 1.115 ' CD1' HD11 ' B' ' 49' ' ' ILE . 14.3 pt -79.27 159.11 4.58 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 C-N-CA 115.798 -2.361 . . . . 43.11 114.124 173.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' HIS . . . . . 0.48 ' HE1' ' O ' ' A' ' 98' ' ' HOH . 42.8 t-80 -125.18 113.98 18.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 102.218 -3.253 . . . . 46.48 102.218 174.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ILE . . . . . 1.115 HD11 ' CD1' ' B' ' 47' ' ' ILE . 1.9 mp -95.26 148.01 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 O-C-N 124.703 1.252 . . . . 43.3 109.627 -177.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.68 -166.14 38.73 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 117.333 -2.365 . . . . 31.07 109.936 175.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -89.61 117.28 28.38 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 119.156 -1.017 . . . . 38.82 109.41 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.06 137.22 21.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.142 0 N-CA-C 103.358 -2.83 . . . . 32.7 103.358 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' MSE . . . . . 0.685 ' HG2' HG12 ' A' ' 47' ' ' ILE . 69.6 mtm -124.22 124.37 42.3 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.088 1.313 . . . . 46.0 110.564 -178.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -112.67 124.75 53.27 Favored 'General case' 0 N--CA 1.442 -0.849 0 O-C-N 124.062 0.851 . . . . 41.35 110.289 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -76.6 139.2 40.55 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 105.775 -1.935 . . . . 47.26 105.775 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 42.6 pt -128.1 162.88 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 108.446 -0.946 . . . . 35.15 108.446 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.03 133.27 55.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.561 -0.533 . . . . 44.78 109.561 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 ttp180 -51.82 -48.76 63.77 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.075 -0.511 . . . . 49.06 111.679 -174.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -67.31 -41.67 84.97 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.252 0.549 . . . . 41.73 111.54 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -59.68 -46.07 90.17 Favored 'General case' 0 C--O 1.26 1.654 0 C-N-CA 119.155 -1.018 . . . . 48.0 112.36 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.76 76.45 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 107.519 -1.289 . . . . 29.64 107.519 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.83 -39.9 91.29 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.571 0.952 . . . . 36.23 113.571 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -66.18 -46.3 77.82 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 123.277 0.361 . . . . 48.23 111.32 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 55.9 p -60.32 -36.1 77.15 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.307 0.855 . . . . 30.9 113.307 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.3 mt -59.84 -26.05 65.5 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 115.034 1.494 . . . . 32.47 115.034 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -58.41 -40.13 81.61 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.567 0.951 . . . . 56.6 113.567 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 86.1 mt -69.14 -46.26 68.07 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.061 0.945 . . . . 41.97 108.67 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -55.94 -45.99 78.63 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 116.685 -2.006 . . . . 33.17 113.638 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLN . . . . . 0.656 ' NE2' ' O ' ' B' ' 99' ' ' HOH . 13.5 mm-40 -53.61 -43.05 68.33 Favored 'General case' 0 C--O 1.25 1.085 0 CA-C-O 121.296 0.569 . . . . 44.68 111.532 178.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.16 -43.96 90.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 59.83 111.119 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 84.5 mt -62.39 -44.81 99.62 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 118.614 0.643 . . . . 38.31 109.721 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.9 -43.74 97.88 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 C-N-CA 120.41 -0.516 . . . . 43.89 110.988 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -60.12 -27.81 67.35 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 53.01 111.322 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -90.72 -45.54 8.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.014 -0.539 . . . . 59.35 111.88 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 7.9 mt -78.91 -64.52 1.16 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 119.318 -0.953 . . . . 65.47 111.318 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.774 0.43 . . . . 76.09 111.872 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . 0.48 ' O ' ' HE1' ' B' ' 48' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 99' ' ' HOH . . . . . 0.656 ' O ' ' NE2' ' B' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . 0.444 ' O ' ' HD2' ' B' ' -3' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.091 -1.078 . . . . 42.420000000000002 108.091 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -62.61 -9.85 10.33 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.426 0.898 . . . . 46.490000000000002 113.426 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' LEU . . . . . . . . . . . . . 4.4 mp -78.96 -20.59 48.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 49.649999999999999 110.742 178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -99.04 112.8 24.83 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.153 -0.619 . . . . 43.350000000000001 112.227 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -62.09 -42.28 99.05 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-O 122.673 1.225 . . . . 40.520000000000003 109.537 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' GLN . . . . . 0.773 ' NE2' ' H ' ' A' ' 1' ' ' MSE . 2.2 pp0? -151.99 177.82 10.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 103.738 -2.69 . . . . 55.880000000000003 103.738 163.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -57.06 -27.31 57.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 117.232 1.653 . . . . 38.369999999999997 117.232 -160.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . 0.773 ' H ' ' NE2' ' A' ' -1' ' ' GLN . 39.2 mtp -117.8 23.82 11.44 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.608 -0.936 . . . . 51.869999999999997 113.184 -174.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.5 t -133.99 151.31 51.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.902 -0.571 . . . . 36.490000000000002 110.552 -175.901 -152.317 -169.68 -113.159 76.323 20.143 118.987 -129.456 61.549 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.33 128.67 50.35 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 123.626 0.77 . . . . 39.950000000000003 110.524 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.6 t -65.27 133.95 52.57 Favored 'General case' 0 C--O 1.208 -1.095 0 C-N-CA 119.72 -0.792 . . . . 29.809999999999999 109.266 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 85.9 mt -95.46 123.6 55.96 Favored Pre-proline 0 N--CA 1.489 1.49 0 N-CA-C 106.478 -1.675 . . . . 27.949999999999999 106.478 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -51.93 128.26 26.11 Favored 'Trans proline' 0 C--O 1.258 1.513 0 O-C-N 123.621 1.327 . . . . 27.0 111.696 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 43.0 m -125.11 131.81 53.22 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.289 -1.004 . . . . 30.359999999999999 108.289 -168.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.58 HE21 ' HA2' ' A' ' 42' ' ' GLY . 64.0 tt0 -80.32 134.07 36.02 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 124.157 0.911 . . . . 32.229999999999997 110.013 -178.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.5 t -77.96 124.75 36.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.095 0 N-CA-C 106.435 -1.691 . . . . 27.079999999999998 106.435 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -117.13 -10.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 113.504 0.928 . . . . 32.270000000000003 113.504 -173.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -160.26 146.87 15.76 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.5 -0.926 . . . . 31.719999999999999 108.5 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 92.1 t -132.95 128.97 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 108.575 -0.898 . . . . 33.609999999999999 108.575 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -128.08 86.44 2.47 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.924 1.345 . . . . 48.770000000000003 109.867 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -68.73 -29.66 68.13 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.314 -0.857 . . . . 34.329999999999998 112.264 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.32 -35.63 79.81 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 118.438 -1.305 . . . . 45.009999999999998 110.736 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -94.75 10.39 35.3 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.003 1.483 . . . . 63.789999999999999 115.003 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 41.06 59.96 2.14 Favored 'General case' 0 CA--C 1.49 -1.333 0 C-N-CA 123.611 0.764 . . . . 43.57 110.768 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -141.06 159.75 41.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.618 -0.833 . . . . 40.520000000000003 111.281 168.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.08 152.38 32.46 Favored 'Isoleucine or valine' 0 C--O 1.25 1.122 0 N-CA-C 108.506 -0.924 . . . . 35.460000000000001 108.506 173.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -109.01 130.33 55.47 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.804 -1.554 . . . . 34.140000000000001 106.804 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.5 m -119.71 154.22 22.46 Favored 'Isoleucine or valine' 0 C--O 1.255 1.376 0 C-N-CA 119.418 -0.913 . . . . 33.710000000000001 109.706 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -113.65 122.37 46.97 Favored 'General case' 0 C--O 1.263 1.772 0 O-C-N 125.326 1.641 . . . . 48.799999999999997 109.353 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.2 m -122.18 111.56 17.11 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 106.309 -1.737 . . . . 33.229999999999997 106.309 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 mt 40.38 43.58 1.5 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 124.783 1.302 . . . . 40.549999999999997 110.023 -171.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.98 -4.63 78.42 Favored Glycine 0 C--O 1.213 -1.171 0 N-CA-C 114.984 0.754 . . . . 40.229999999999997 114.984 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.7 t -100.91 128.28 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 107.329 -1.36 . . . . 35.969999999999999 107.329 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -95.48 137.96 33.82 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-N 115.873 -0.603 . . . . 43.020000000000003 110.695 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mtm-85 -137.82 135.96 36.73 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 117.937 -1.03 . . . . 47.700000000000003 108.859 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -96.13 132.09 41.89 Favored 'General case' 0 C--O 1.253 1.288 0 N-CA-C 102.204 -3.258 . . . . 54.140000000000001 102.204 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 26.3 m -135.67 147.08 28.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 C-N-CA 120.565 -0.454 . . . . 37.990000000000002 110.411 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 t -59.52 139.91 56.73 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.183 -1.043 . . . . 38.100000000000001 108.183 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 95.5 p -102.3 16.65 25.59 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.684 0.624 . . . . 31.48 112.684 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -57.73 -30.43 65.56 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.884 1.809 . . . . 49.43 115.884 -177.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.8 mt -107.8 24.15 13.37 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.719 1.007 . . . . 38.880000000000003 113.719 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 3.1 ptt? -67.63 139.62 56.83 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 117.059 -1.857 . . . . 39.960000000000001 108.5 169.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.2 p -86.25 -14.39 43.95 Favored 'General case' 0 C--O 1.251 1.174 0 O-C-N 120.43 -1.419 . . . . 38.270000000000003 112.646 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -153.96 164.19 21.51 Favored Pre-proline 0 C--O 1.275 2.433 0 N-CA-C 108.755 -0.831 . . . . 41.450000000000003 108.755 170.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -61.34 140.55 88.83 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 122.982 0.991 . . . . 30.620000000000001 112.152 -177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -113.17 152.85 29.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 121.881 0.848 . . . . 29.68 113.06 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.68 160.08 39.24 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.626 -1.17 . . . . 29.649999999999999 112.281 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.6 mt -50.32 131.16 9.98 Favored 'Isoleucine or valine' 0 C--O 1.264 1.86 0 CA-C-O 121.52 0.676 . . . . 39.93 112.207 170.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.58 ' HA2' HE21 ' A' ' 8' ' ' GLN . . . 90.8 -10.92 73.44 Favored Glycine 0 C--O 1.22 -0.748 0 N-CA-C 119.969 2.747 . . . . 30.41 119.969 -175.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -67.7 152.4 45.67 Favored 'General case' 0 C--O 1.196 -1.712 0 N-CA-C 106.764 -1.569 . . . . 34.280000000000001 106.764 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -110.72 138.69 46.8 Favored 'General case' 0 C--O 1.273 2.306 0 N-CA-C 106.299 -1.741 . . . . 35.899999999999999 106.299 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.01 152.06 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-N 114.537 -1.21 . . . . 27.23 112.366 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.5 mt -103.0 140.33 37.4 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.303 -1.369 . . . . 29.77 107.303 160.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.685 HG12 ' HG2' ' B' ' 53' ' ' MSE . 43.4 mt -123.06 142.43 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 106.713 -1.588 . . . . 36.259999999999998 106.713 -171.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -145.94 155.23 42.71 Favored 'General case' 0 C--O 1.248 1.022 0 N-CA-C 108.446 -0.946 . . . . 38.32 108.446 173.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.5 mt -76.72 129.19 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 104.599 -2.371 . . . . 40.759999999999998 104.599 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.83 -158.63 8.71 Favored Glycine 0 C--O 1.218 -0.906 0 C-N-CA 117.428 -2.32 . . . . 30.59 110.537 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -160.45 172.22 17.63 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 117.957 -1.497 . . . . 40.109999999999999 110.01 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.3 m -133.19 165.63 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 105.436 -2.061 . . . . 31.440000000000001 105.436 170.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' MSE . . . . . . . . . . . . . 77.3 mtm -111.64 123.72 50.82 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.23 -0.655 . . . . 44.560000000000002 109.23 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.533 ' ND2' HG21 ' B' ' 36' ' ' THR . 16.9 m120 -107.83 140.87 40.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 O-C-N 123.992 0.807 . . . . 41.490000000000002 109.098 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -74.96 147.23 41.04 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 118.346 -1.342 . . . . 52.43 110.094 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 tt -127.91 139.6 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.077 -1.453 . . . . 36.390000000000001 107.077 172.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -48.4 131.74 16.83 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 123.239 0.337 . . . . 47.030000000000001 111.047 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.515 ' HG2' HH21 ' A' ' 58' ' ' ARG . 3.7 ttm180 -60.22 -43.23 96.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 119.838 -0.745 . . . . 36.93 110.699 -171.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.01 -38.21 90.23 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.093 1.516 . . . . 42.380000000000003 115.093 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -66.14 -43.08 88.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.005 -0.998 . . . . 47.439999999999998 112.242 172.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.13 -55.38 31.78 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-O 122.667 1.222 . . . . 31.16 111.82 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 77.8 mt -59.2 -38.74 80.62 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.564 0.95 . . . . 35.149999999999999 113.564 -177.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -66.9 -41.24 87.46 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 119.728 -0.789 . . . . 54.340000000000003 111.426 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 94.3 p -73.86 -27.42 61.07 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 121.606 -0.683 . . . . 37.270000000000003 112.549 -176.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 mt -60.24 -30.25 69.29 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 114.259 1.207 . . . . 35.159999999999997 114.259 -172.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.61 -37.57 84.41 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 118.777 -1.169 . . . . 55.810000000000002 111.815 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.88 -38.99 87.35 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.125 0.488 . . . . 41.380000000000003 111.905 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -63.22 -45.28 92.38 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-O 121.186 0.517 . . . . 35.140000000000001 111.734 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -60.42 -37.73 81.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.293 1.22 . . . . 55.969999999999999 114.293 174.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -65.62 -37.46 86.64 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 121.695 -0.628 . . . . 53.259999999999998 110.928 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 60.3 mt -62.48 -51.83 67.42 Favored 'Isoleucine or valine' 0 C--O 1.27 2.177 0 N-CA-C 108.528 -0.916 . . . . 35.350000000000001 108.528 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.07 -43.72 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 115.776 -0.647 . . . . 43.219999999999999 110.808 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.4 m -59.65 -39.09 83.24 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.42 0.45 . . . . 51.560000000000002 111.965 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.0 ttmm -74.78 -35.31 62.53 Favored 'General case' 0 C--O 1.241 0.611 0 O-C-N 123.402 0.439 . . . . 56.310000000000002 111.916 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.4 mt -104.83 -4.15 22.61 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.87 2.544 . . . . 49.049999999999997 117.87 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-N 118.559 0.618 . . . . 72.209999999999994 109.794 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' -3' ' ' TYR . . . . . 0.444 ' HD2' ' O ' ' B' ' 115' ' ' HOH . 13.1 t80 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 114.481 1.289 . . . . 61.579999999999998 114.481 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' -2' ' ' PHE . . . . . 0.629 ' CE2' HG22 ' B' ' 49' ' ' ILE 0.404 12.9 p90 -68.98 -15.94 63.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 117.015 -1.874 . . . . 48.590000000000003 114.897 171.454 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' -1' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -57.6 -26.08 61.0 Favored 'General case' 0 C--O 1.253 1.284 0 N-CA-C 108.886 -0.783 . . . . 44.560000000000002 108.886 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' GLY . . . . . . . . . . . . . . . -66.84 -14.19 62.68 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.605 -0.725 . . . . 40.100000000000001 113.751 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MSE . . . . . . . . . . . . . 19.0 mtp -89.06 -5.44 57.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 114.665 1.357 . . . . 48.689999999999998 114.665 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -149.78 162.79 39.57 Favored 'General case' 0 CA--C 1.497 -1.073 0 C-N-CA 118.78 -1.168 . . . . 37.280000000000001 110.077 -177.493 61.549 -129.456 -113.159 118.987 20.143 76.323 -169.68 -152.317 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 12.9 mt -108.26 121.91 45.87 Favored 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 109.008 -0.738 . . . . 39.240000000000002 109.008 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 70.9 m -67.98 142.59 55.92 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.277 -1.379 . . . . 33.619999999999997 107.277 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 82.4 mt -99.53 127.63 33.72 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 106.251 -1.759 . . . . 30.140000000000001 106.251 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -57.65 130.33 38.18 Favored 'Trans proline' 0 C--O 1.251 1.166 0 C-N-CA 116.517 -1.855 . . . . 27.75 111.635 175.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' SER . . . . . 0.576 ' HB3' HG12 ' B' ' 21' ' ' VAL . 33.4 m -128.87 131.73 47.68 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 117.968 -1.015 . . . . 28.949999999999999 109.998 -170.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -88.79 137.22 32.51 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.671 0.669 . . . . 38.82 112.199 -174.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.34 115.75 18.42 Favored 'Isoleucine or valine' 0 C--O 1.28 2.696 0 N-CA-C 108.017 -1.105 . . . . 28.359999999999999 108.017 170.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 34.8 m -113.62 -8.83 12.21 Favored 'Isoleucine or valine' 0 C--O 1.265 1.883 0 C-N-CA 124.684 1.194 . . . . 31.440000000000001 113.626 -171.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.43 152.03 26.97 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.32 -0.992 . . . . 31.359999999999999 108.32 171.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 92.5 t -138.77 123.96 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.239 -1.393 . . . . 34.560000000000002 107.239 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -118.96 97.22 5.59 Favored 'General case' 0 C--O 1.212 -0.908 0 N-CA-C 106.891 -1.522 . . . . 52.0 106.891 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -77.66 -12.48 59.97 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.441 0.904 . . . . 37.020000000000003 113.441 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -79.92 -36.63 36.09 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.443 -1.303 . . . . 56.140000000000001 109.385 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -84.6 -12.98 52.97 Favored 'General case' 0 C--O 1.258 1.505 0 CA-C-O 122.006 0.908 . . . . 67.469999999999999 112.101 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 50.05 53.94 11.95 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.901 0.858 . . . . 40.200000000000003 111.362 -170.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 80.8 p -132.57 160.18 37.31 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 114.763 -1.108 . . . . 41.710000000000001 110.45 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.26 159.1 39.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 CA-C-N 115.112 -0.949 . . . . 35.549999999999997 108.528 171.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 25.9 m -111.59 139.54 46.94 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 106.494 -1.669 . . . . 33.130000000000003 106.494 170.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.576 HG12 ' HB3' ' B' ' 7' ' ' SER . 4.8 m -130.63 127.1 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-O 122.772 1.273 . . . . 30.239999999999998 109.067 171.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -102.36 128.86 48.76 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 113.553 -1.658 . . . . 48.810000000000002 108.736 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 49.6 m -124.31 105.66 9.64 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 104.615 -2.365 . . . . 30.82 104.615 -177.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.6 mt 43.79 44.46 5.66 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 125.65 1.844 . . . . 35.719999999999999 112.093 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.2 -11.07 65.65 Favored Glycine 0 N--CA 1.473 1.163 0 N-CA-C 117.085 1.594 . . . . 38.619999999999997 117.085 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 76.8 t -104.35 126.94 59.03 Favored 'Isoleucine or valine' 0 C--O 1.253 1.245 0 CA-C-N 118.48 1.14 . . . . 37.859999999999999 111.895 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 84.6 mtt180 -102.98 139.04 39.07 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 114.82 1.415 . . . . 38.219999999999999 114.82 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -136.57 141.82 43.34 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 107.984 -1.117 . . . . 42.18 107.984 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -88.59 135.63 33.4 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 123.458 0.474 . . . . 50.350000000000001 110.9 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 89.3 t -132.36 143.96 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 N-CA-C 107.914 -1.143 . . . . 37.969999999999999 107.914 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 37.7 t -59.02 131.76 52.02 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.427 0.899 . . . . 37.049999999999997 113.427 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.0 m -62.34 -20.08 64.01 Favored 'General case' 0 C--O 1.248 1.002 0 N-CA-C 112.795 0.665 . . . . 36.170000000000002 112.795 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -69.13 -13.71 62.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 118.772 -1.171 . . . . 54.0 109.794 -177.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.3 mt -86.63 -0.81 56.93 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 113.457 0.91 . . . . 41.689999999999998 113.457 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' MSE . . . . . 0.508 ' HG2' HD12 ' B' ' 39' ' ' LEU . 52.3 mtt -67.2 129.31 39.49 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.675 0.67 . . . . 49.380000000000003 111.754 172.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' THR . . . . . 0.533 HG21 ' ND2' ' A' ' 54' ' ' ASN . 69.3 p -82.85 -20.99 34.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 118.434 -1.306 . . . . 40.240000000000002 110.021 178.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.488 ' HB2' ' HD2' ' B' ' 38' ' ' PRO . 11.9 pt-20 -148.11 166.04 16.79 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 106.998 -1.482 . . . . 51.630000000000003 106.998 172.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.488 ' HD2' ' HB2' ' B' ' 37' ' ' GLU . 1.5 Cg_endo -55.41 124.81 17.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.14 1.227 . . . . 37.990000000000002 113.037 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.508 HD12 ' HG2' ' B' ' 35' ' ' MSE . 48.3 mt -112.08 149.94 31.41 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.176 -0.465 . . . . 39.640000000000001 109.752 174.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -127.81 165.22 20.54 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 124.008 0.818 . . . . 31.039999999999999 111.43 175.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 5.5 tp -49.17 137.34 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 123.022 0.201 . . . . 31.239999999999998 111.132 175.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.66 -14.36 52.06 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 117.754 1.862 . . . . 30.75 117.754 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -70.26 158.85 35.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.204 1.002 . . . . 37.140000000000001 109.62 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -111.44 143.83 41.63 Favored 'General case' 0 C--O 1.27 2.143 0 O-C-N 124.948 1.405 . . . . 31.440000000000001 110.149 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.39 157.1 42.19 Favored 'Isoleucine or valine' 0 C--O 1.249 1.041 0 C-N-CA 119.357 -0.937 . . . . 30.579999999999998 108.499 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.4 mt -124.52 131.4 53.49 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 102.523 -3.14 . . . . 37.539999999999999 102.523 170.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . 1.115 ' CD1' HD11 ' B' ' 49' ' ' ILE . 14.3 pt -79.27 159.11 4.58 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 C-N-CA 115.798 -2.361 . . . . 43.109999999999999 114.124 173.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' HIS . . . . . 0.48 ' HE1' ' O ' ' A' ' 98' ' ' HOH . 42.8 t-80 -125.18 113.98 18.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 102.218 -3.253 . . . . 46.479999999999997 102.218 174.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ILE . . . . . 1.115 HD11 ' CD1' ' B' ' 47' ' ' ILE . 1.9 mp -95.26 148.01 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 O-C-N 124.703 1.252 . . . . 43.299999999999997 109.627 -177.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.68 -166.14 38.73 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 117.333 -2.365 . . . . 31.07 109.936 175.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -89.61 117.28 28.38 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 119.156 -1.017 . . . . 38.82 109.41 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.06 137.22 21.22 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.142 0 N-CA-C 103.358 -2.83 . . . . 32.700000000000003 103.358 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' MSE . . . . . 0.685 ' HG2' HG12 ' A' ' 47' ' ' ILE . 69.6 mtm -124.22 124.37 42.3 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.088 1.313 . . . . 46.0 110.564 -178.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -112.67 124.75 53.27 Favored 'General case' 0 N--CA 1.442 -0.849 0 O-C-N 124.062 0.851 . . . . 41.350000000000001 110.289 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -76.6 139.2 40.55 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 105.775 -1.935 . . . . 47.259999999999998 105.775 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 42.6 pt -128.1 162.88 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 108.446 -0.946 . . . . 35.149999999999999 108.446 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -62.03 133.27 55.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.561 -0.533 . . . . 44.780000000000001 109.561 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 ttp180 -51.82 -48.76 63.77 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.075 -0.511 . . . . 49.060000000000002 111.679 -174.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -67.31 -41.67 84.97 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.252 0.549 . . . . 41.729999999999997 111.54 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -59.68 -46.07 90.17 Favored 'General case' 0 C--O 1.26 1.654 0 C-N-CA 119.155 -1.018 . . . . 48.0 112.36 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.76 76.45 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 107.519 -1.289 . . . . 29.640000000000001 107.519 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.83 -39.9 91.29 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.571 0.952 . . . . 36.229999999999997 113.571 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -66.18 -46.3 77.82 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 123.277 0.361 . . . . 48.229999999999997 111.32 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 55.9 p -60.32 -36.1 77.15 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.307 0.855 . . . . 30.899999999999999 113.307 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 20.3 mt -59.84 -26.05 65.5 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 115.034 1.494 . . . . 32.469999999999999 115.034 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -58.41 -40.13 81.61 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.567 0.951 . . . . 56.600000000000001 113.567 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 86.1 mt -69.14 -46.26 68.07 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.061 0.945 . . . . 41.969999999999999 108.67 177.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -55.94 -45.99 78.63 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 116.685 -2.006 . . . . 33.170000000000002 113.638 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.656 ' NE2' ' O ' ' B' ' 99' ' ' HOH . 2.5 mm100 -53.61 -43.05 68.33 Favored 'General case' 0 C--O 1.25 1.085 0 CA-C-O 121.296 0.569 . . . . 44.68 111.532 178.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.16 -43.96 90.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 59.829999999999998 111.119 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 84.5 mt -62.39 -44.81 99.62 Favored 'Isoleucine or valine' 0 C--O 1.266 1.943 0 CA-C-N 118.614 0.643 . . . . 38.310000000000002 109.721 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.9 -43.74 97.88 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 C-N-CA 120.41 -0.516 . . . . 43.890000000000001 110.988 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -60.12 -27.81 67.35 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 53.009999999999998 111.322 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -90.72 -45.54 8.79 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.014 -0.539 . . . . 59.350000000000001 111.88 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 7.9 mt -78.91 -64.52 1.16 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 119.318 -0.953 . . . . 65.469999999999999 111.318 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.774 0.43 . . . . 76.090000000000003 111.872 178.485 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . 0.48 ' O ' ' HE1' ' B' ' 48' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' HOH . . . . . 0.656 ' O ' ' NE2' ' B' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . 0.444 ' O ' ' HD2' ' B' ' -3' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_