data_5o3j_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 5o3j _Structure_validation_residue.Date_analyzed 2017-06-30 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 ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.601 0 N-CA-C 113.392 0.117 . . . . 127.8 113.392 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . -73.16 132.6 43.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.497 0.319 . . . . 124.61 110.312 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -70.62 157.26 38.27 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.937 0.718 . . . . 119.03 112.937 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -110.49 172.33 6.93 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.301 -0.863 . . . . 109.56 109.876 176.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -107.61 111.86 24.31 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.149 0.58 . . . . 102.94 110.153 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -95.98 134.35 39.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.274 0.629 . . . . 89.920000000000002 112.637 -168.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.8 t -115.56 118.7 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 C-N-CA 123.496 0.719 . . . . 80.010000000000005 109.725 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -76.42 138.97 40.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.263 0.625 . . . . 71.540000000000006 109.694 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -129.43 115.68 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 107.928 -1.138 . . . . 71.409999999999997 107.928 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.03 166.12 13.0 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 123.206 0.431 . . . . 75.909999999999997 113.191 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 58.8 56.75 3.97 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.394 1.078 . . . . 81.590000000000003 112.904 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.0 143.63 26.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.971 -1.013 . . . . 84.810000000000002 109.781 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.3 t -65.37 145.62 99.05 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 109.069 -0.715 . . . . 89.890000000000001 109.069 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.91 -23.59 74.21 Favored 'Trans proline' 0 C--N 1.353 0.764 0 N-CA-C 115.18 1.184 . . . . 93.219999999999999 115.18 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . . . -76.36 -13.7 60.12 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.991 1.108 . . . . 95.840000000000003 113.991 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -72.44 133.6 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 122.494 0.318 . . . . 92.0 111.033 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 p -115.4 178.54 4.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.996 0.918 . . . . 88.450000000000003 111.034 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.0 m -66.11 -28.43 68.81 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.929 0.714 . . . . 83.989999999999995 112.929 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -67.38 -52.63 37.66 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.855 0.687 . . . . 90.819999999999993 112.855 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -80.42 -27.16 38.08 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.613 1.338 . . . . 96.980000000000004 114.613 -176.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . . . -69.06 -30.79 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 117.8 0.273 . . . . 88.969999999999999 111.695 172.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -69.2 -39.57 78.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.317 0.247 . . . . 84.819999999999993 111.528 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.17 -32.85 74.22 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.519 0.933 . . . . 84.870000000000005 113.519 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.14 -33.07 67.49 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.021 0.748 . . . . 84.099999999999994 113.021 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -99.18 -0.27 41.89 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.238 1.199 . . . . 85.200000000000003 114.238 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.51 -37.26 12.05 Favored Pre-proline 0 N--CA 1.475 0.815 0 N-CA-C 115.024 1.49 . . . . 87.239999999999995 115.024 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -57.59 -20.3 41.18 Favored 'Trans proline' 0 C--N 1.356 0.973 0 N-CA-C 117.578 2.107 . . . . 93.150000000000006 117.578 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -81.41 -42.73 19.96 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.957 0.344 . . . . 95.060000000000002 111.563 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -179.22 -176.18 46.75 Favored Glycine 0 N--CA 1.465 0.587 0 CA-C-N 116.464 -0.335 . . . . 93.890000000000001 112.534 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.1 ttt-85 -70.52 146.41 50.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.697 0.284 . . . . 92.420000000000002 110.57 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.5 mt -115.1 121.3 66.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.652 -0.704 . . . . 86.560000000000002 109.483 -172.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -71.45 -41.52 69.33 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.276 0.36 . . . . 87.870000000000005 111.106 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -156.76 146.32 20.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.231 -0.44 . . . . 90.0 110.854 173.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -145.31 144.68 30.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 83.989999999999995 109.486 171.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.7 ptt180 -161.58 158.67 26.64 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.538 0.94 . . . . 82.569999999999993 113.538 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -104.74 130.3 55.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 106.631 -1.618 . . . . 83.549999999999997 106.631 169.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.8 t -77.6 112.98 16.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 109.084 -0.71 . . . . 83.810000000000002 109.084 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -93.78 155.86 16.98 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.551 -0.537 . . . . 87.620000000000005 109.551 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.88 131.33 41.38 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 109.114 -0.698 . . . . 92.489999999999995 109.114 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . . . -62.4 -35.09 78.11 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.172 0.804 . . . . 93.340000000000003 113.172 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.45 -64.49 0.98 Allowed 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.141 0.276 . . . . 93.150000000000006 111.634 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 59.3 p -78.7 -48.52 14.8 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.835 0.68 . . . . 94.909999999999997 112.835 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.12 -5.72 56.08 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 114.619 0.608 . . . . 91.079999999999998 114.619 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . . . -72.08 160.39 32.56 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 117.211 0.505 . . . . 87.489999999999995 110.407 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.3 t -67.63 129.05 38.7 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.757 -0.656 . . . . 84.849999999999994 110.33 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . . . -67.72 -30.95 70.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.241 0.46 . . . . 83.430000000000007 112.241 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 131.06 -22.05 4.55 Favored Glycine 0 N--CA 1.466 0.683 0 N-CA-C 114.352 0.501 . . . . 80.120000000000005 114.352 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -130.23 170.47 14.05 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.392 0.516 . . . . 80.390000000000001 112.392 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.47 -178.9 28.46 Favored Glycine 0 N--CA 1.466 0.655 0 CA-C-N 115.619 -0.719 . . . . 71.299999999999997 113.291 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -132.57 148.51 52.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.177 0.591 . . . . 70.420000000000002 111.079 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.2 t -141.51 110.6 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.638 -0.875 . . . . 75.439999999999998 108.638 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.0 p -99.76 116.61 32.25 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.618 0.367 . . . . 83.400000000000006 111.586 -178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -93.0 157.97 16.04 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 122.96 0.504 . . . . 91.870000000000005 110.956 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -75.12 -47.62 27.74 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.881 -0.6 . . . . 93.879999999999995 110.648 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -89.88 150.77 22.06 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.689 0.796 . . . . 96.540000000000006 110.054 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -91.01 -39.43 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 111.73 0.271 . . . . 100.83 111.73 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -76.7 68.72 2.99 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 108.254 -1.017 . . . . 108.22 108.254 171.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.7 t0 178.89 -55.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.204 -1.036 . . . . 115.02 108.204 -162.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.29 75.42 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.173 -0.677 . . . . 102.94 109.173 167.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -50.7 -40.9 55.3 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.904 0.881 . . . . 106.20999999999999 113.017 171.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -67.37 -49.23 64.82 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.193 0.308 . . . . 107.73 111.32 171.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -33.32 68.45 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.299 1.222 . . . . 96.040000000000006 114.299 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -72.36 -47.76 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 122.347 0.259 . . . . 92.620000000000005 111.208 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -42.4 73.93 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.298 0.481 . . . . 102.89 112.298 -177.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.02 -40.29 62.98 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.947 0.721 . . . . 103.34 112.947 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 71.2 mmm -89.12 3.4 51.96 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.571 1.323 . . . . 93.620000000000005 114.571 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.0 85.28 0.17 Allowed Glycine 0 N--CA 1.467 0.728 0 CA-C-N 118.109 0.413 . . . . 96.670000000000002 113.853 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 101.92 10.8 39.08 Favored Glycine 0 N--CA 1.466 0.676 0 N-CA-C 115.619 1.008 . . . . 97.129999999999995 115.619 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -77.96 149.89 34.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 117.497 0.648 . . . . 97.390000000000001 110.513 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -79.01 134.03 36.8 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.013 -0.539 . . . . 93.090000000000003 111.174 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tt -150.09 111.3 4.4 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 108.658 -0.867 . . . . 91.459999999999994 108.658 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.2 38.57 92.05 Favored Glycine 0 N--CA 1.463 0.488 0 CA-C-N 116.225 -0.443 . . . . 91.480000000000004 113.097 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.77 27.24 73.21 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 115.777 1.071 . . . . 89.849999999999994 115.777 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -146.86 137.47 23.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.879 0.472 . . . . 92.480000000000004 110.959 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -74.78 139.97 43.69 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.3 -0.629 . . . . 86.140000000000001 109.3 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.8 pt -111.9 148.77 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 123.664 0.602 . . . . 80.069999999999993 111.939 -174.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -85.24 153.31 22.7 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.457 -0.942 . . . . 77.459999999999994 108.457 166.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 p -144.03 136.65 26.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.457 0.473 . . . . 76.760000000000005 110.882 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -167.09 178.27 5.78 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.649 -0.871 . . . . 79.849999999999994 108.649 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 97.8 m95 . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.904 0.859 . . . . 69.870000000000005 111.978 -177.576 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.523 -0.475 0 O4'-C1'-N19 110.084 1.884 . 0.0 '__' . 113.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' U' . . . . . 0.473 ' O2 ' " O4'" ' B' ' 2' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.42 0.479 0 N19-C1'-C2' 115.434 1.271 . 0.0 OUTLIER zeta-1 115.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.87 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.601 0 N-CA-C 113.392 0.117 . . . . 127.8 113.392 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . -73.16 132.6 43.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.497 0.319 . . . . 124.61 110.312 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -70.62 157.26 38.27 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.937 0.718 . . . . 119.03 112.937 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -110.49 172.33 6.93 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.301 -0.863 . . . . 109.56 109.876 176.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -107.61 111.86 24.31 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.149 0.58 . . . . 102.94 110.153 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -95.98 134.35 39.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.274 0.629 . . . . 89.920000000000002 112.637 -168.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.8 t -115.56 118.7 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 C-N-CA 123.496 0.719 . . . . 80.010000000000005 109.725 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -76.42 138.97 40.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.263 0.625 . . . . 71.540000000000006 109.694 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -129.43 115.68 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 107.928 -1.138 . . . . 71.409999999999997 107.928 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.03 166.12 13.0 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 123.206 0.431 . . . . 75.909999999999997 113.191 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 58.8 56.75 3.97 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.394 1.078 . . . . 81.590000000000003 112.904 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.0 143.63 26.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.971 -1.013 . . . . 84.810000000000002 109.781 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.3 t -65.37 145.62 99.05 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 109.069 -0.715 . . . . 89.890000000000001 109.069 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.91 -23.59 74.21 Favored 'Trans proline' 0 C--N 1.353 0.764 0 N-CA-C 115.18 1.184 . . . . 93.219999999999999 115.18 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . . . -76.36 -13.7 60.12 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.991 1.108 . . . . 95.840000000000003 113.991 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -72.44 133.6 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 122.494 0.318 . . . . 92.0 111.033 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 p -115.4 178.54 4.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.996 0.918 . . . . 88.450000000000003 111.034 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . 0.416 HG23 ' HA ' ' A' ' 30' ' ' ARG . 50.0 m -66.11 -28.43 68.81 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.929 0.714 . . . . 83.989999999999995 112.929 173.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -67.38 -52.63 37.66 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.855 0.687 . . . . 90.819999999999993 112.855 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -80.42 -27.16 38.08 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.613 1.338 . . . . 96.980000000000004 114.613 -176.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . . . -69.06 -30.79 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 117.8 0.273 . . . . 88.969999999999999 111.695 172.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -69.2 -39.57 78.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.317 0.247 . . . . 84.819999999999993 111.528 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.17 -32.85 74.22 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.519 0.933 . . . . 84.870000000000005 113.519 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.14 -33.07 67.49 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.021 0.748 . . . . 84.099999999999994 113.021 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -99.18 -0.27 41.89 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.238 1.199 . . . . 85.200000000000003 114.238 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.51 -37.26 12.05 Favored Pre-proline 0 N--CA 1.475 0.815 0 N-CA-C 115.024 1.49 . . . . 87.239999999999995 115.024 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -57.59 -20.3 41.18 Favored 'Trans proline' 0 C--N 1.356 0.973 0 N-CA-C 117.578 2.107 . . . . 93.150000000000006 117.578 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -81.41 -42.73 19.96 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.957 0.344 . . . . 95.060000000000002 111.563 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -179.22 -176.18 46.75 Favored Glycine 0 N--CA 1.465 0.587 0 CA-C-N 116.464 -0.335 . . . . 93.890000000000001 112.534 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.1 ttt-85 -70.52 146.41 50.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.697 0.284 . . . . 92.420000000000002 110.57 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.5 mt -115.1 121.3 66.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.652 -0.704 . . . . 86.560000000000002 109.483 -172.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -71.45 -41.52 69.33 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.276 0.36 . . . . 87.870000000000005 111.106 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -156.76 146.32 20.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.231 -0.44 . . . . 90.0 110.854 173.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -145.31 144.68 30.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 83.989999999999995 109.486 171.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.416 ' HA ' HG23 ' A' ' 13' ' ' THR . 7.7 ptt180 -161.58 158.67 26.64 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.538 0.94 . . . . 82.569999999999993 113.538 176.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -104.74 130.3 55.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 106.631 -1.618 . . . . 83.549999999999997 106.631 169.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.8 t -77.6 112.98 16.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 109.084 -0.71 . . . . 83.810000000000002 109.084 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -93.78 155.86 16.98 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.551 -0.537 . . . . 87.620000000000005 109.551 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.88 131.33 41.38 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 109.114 -0.698 . . . . 92.489999999999995 109.114 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . . . -62.4 -35.09 78.11 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.172 0.804 . . . . 93.340000000000003 113.172 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.45 -64.49 0.98 Allowed 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.141 0.276 . . . . 93.150000000000006 111.634 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 59.3 p -78.7 -48.52 14.8 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.835 0.68 . . . . 94.909999999999997 112.835 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.12 -5.72 56.08 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 114.619 0.608 . . . . 91.079999999999998 114.619 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . . . -72.08 160.39 32.56 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 117.211 0.505 . . . . 87.489999999999995 110.407 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.3 t -67.63 129.05 38.7 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.757 -0.656 . . . . 84.849999999999994 110.33 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . . . -67.72 -30.95 70.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.241 0.46 . . . . 83.430000000000007 112.241 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 131.06 -22.05 4.55 Favored Glycine 0 N--CA 1.466 0.683 0 N-CA-C 114.352 0.501 . . . . 80.120000000000005 114.352 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -130.23 170.47 14.05 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.392 0.516 . . . . 80.390000000000001 112.392 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.47 -178.9 28.46 Favored Glycine 0 N--CA 1.466 0.655 0 CA-C-N 115.619 -0.719 . . . . 71.299999999999997 113.291 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -132.57 148.51 52.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.177 0.591 . . . . 70.420000000000002 111.079 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.2 t -141.51 110.6 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.638 -0.875 . . . . 75.439999999999998 108.638 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.0 p -99.76 116.61 32.25 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.618 0.367 . . . . 83.400000000000006 111.586 -178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -93.0 157.97 16.04 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 122.96 0.504 . . . . 91.870000000000005 110.956 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -75.12 -47.62 27.74 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.881 -0.6 . . . . 93.879999999999995 110.648 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -89.88 150.77 22.06 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.689 0.796 . . . . 96.540000000000006 110.054 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -91.01 -39.43 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 111.73 0.271 . . . . 100.83 111.73 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -76.7 68.72 2.99 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 108.254 -1.017 . . . . 108.22 108.254 171.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.7 t0 178.89 -55.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.204 -1.036 . . . . 115.02 108.204 -162.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.29 75.42 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.173 -0.677 . . . . 102.94 109.173 167.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -50.7 -40.9 55.3 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.904 0.881 . . . . 106.20999999999999 113.017 171.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -67.37 -49.23 64.82 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.193 0.308 . . . . 107.73 111.32 171.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -33.32 68.45 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.299 1.222 . . . . 96.040000000000006 114.299 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -72.36 -47.76 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 122.347 0.259 . . . . 92.620000000000005 111.208 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -69.76 -42.4 73.93 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.298 0.481 . . . . 102.89 112.298 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.02 -40.29 62.98 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.947 0.721 . . . . 103.34 112.947 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 71.2 mmm -89.12 3.4 51.96 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.571 1.323 . . . . 93.620000000000005 114.571 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.0 85.28 0.17 Allowed Glycine 0 N--CA 1.467 0.728 0 CA-C-N 118.109 0.413 . . . . 96.670000000000002 113.853 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 101.92 10.8 39.08 Favored Glycine 0 N--CA 1.466 0.676 0 N-CA-C 115.619 1.008 . . . . 97.129999999999995 115.619 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -77.96 149.89 34.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 117.497 0.648 . . . . 97.390000000000001 110.513 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -79.01 134.03 36.8 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.013 -0.539 . . . . 93.090000000000003 111.174 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tt -150.09 111.3 4.4 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 108.658 -0.867 . . . . 91.459999999999994 108.658 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.2 38.57 92.05 Favored Glycine 0 N--CA 1.463 0.488 0 CA-C-N 116.225 -0.443 . . . . 91.480000000000004 113.097 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.77 27.24 73.21 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 115.777 1.071 . . . . 89.849999999999994 115.777 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -146.86 137.47 23.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.879 0.472 . . . . 92.480000000000004 110.959 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -74.78 139.97 43.69 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.3 -0.629 . . . . 86.140000000000001 109.3 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.8 pt -111.9 148.77 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 123.664 0.602 . . . . 80.069999999999993 111.939 -174.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -85.24 153.31 22.7 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.457 -0.942 . . . . 77.459999999999994 108.457 166.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 p -144.03 136.65 26.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.457 0.473 . . . . 76.760000000000005 110.882 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -167.09 178.27 5.78 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.649 -0.871 . . . . 79.849999999999994 108.649 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 97.8 m95 . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.904 0.859 . . . . 69.870000000000005 111.978 -177.576 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.523 -0.475 0 O4'-C1'-N19 110.084 1.884 . 0.0 '__' . 113.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' U' . . . . . 0.473 ' O2 ' " O4'" ' B' ' 2' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.42 0.479 0 N19-C1'-C2' 115.434 1.271 . 0.0 OUTLIER zeta-1 115.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.87 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.601 0 N-CA-C 113.392 0.117 . . . . 127.8 113.392 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . -73.16 132.6 43.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.497 0.319 . . . . 124.61 110.312 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -70.62 157.26 38.27 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.937 0.718 . . . . 119.03 112.937 -175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -110.49 172.33 6.93 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.301 -0.863 . . . . 109.56 109.876 176.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -107.61 111.86 24.31 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.149 0.58 . . . . 102.94 110.153 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -95.98 134.35 39.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.274 0.629 . . . . 89.920000000000002 112.637 -168.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.8 t -115.56 118.7 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 C-N-CA 123.496 0.719 . . . . 80.010000000000005 109.725 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -76.42 138.97 40.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.263 0.625 . . . . 71.540000000000006 109.694 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -129.43 115.68 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 107.928 -1.138 . . . . 71.409999999999997 107.928 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.03 166.12 13.0 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 123.206 0.431 . . . . 75.909999999999997 113.191 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 58.8 56.75 3.97 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.394 1.078 . . . . 81.590000000000003 112.904 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.0 143.63 26.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.971 -1.013 . . . . 84.810000000000002 109.781 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.3 t -65.37 145.62 99.05 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 109.069 -0.715 . . . . 89.890000000000001 109.069 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.91 -23.59 74.21 Favored 'Trans proline' 0 C--N 1.353 0.764 0 N-CA-C 115.18 1.184 . . . . 93.219999999999999 115.18 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . . . -76.36 -13.7 60.12 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.991 1.108 . . . . 95.840000000000003 113.991 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -72.44 133.6 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 122.494 0.318 . . . . 92.0 111.033 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 p -115.4 178.54 4.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.996 0.918 . . . . 88.450000000000003 111.034 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . 0.416 HG23 ' HA ' ' A' ' 30' ' ' ARG . 50.0 m -66.11 -28.43 68.81 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.929 0.714 . . . . 83.989999999999995 112.929 173.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -67.38 -52.63 37.66 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.855 0.687 . . . . 90.819999999999993 112.855 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -80.42 -27.16 38.08 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.613 1.338 . . . . 96.980000000000004 114.613 -176.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . . . -69.06 -30.79 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 117.8 0.273 . . . . 88.969999999999999 111.695 172.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -69.2 -39.57 78.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.317 0.247 . . . . 84.819999999999993 111.528 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.17 -32.85 74.22 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.519 0.933 . . . . 84.870000000000005 113.519 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.14 -33.07 67.49 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.021 0.748 . . . . 84.099999999999994 113.021 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -99.18 -0.27 41.89 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.238 1.199 . . . . 85.200000000000003 114.238 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.51 -37.26 12.05 Favored Pre-proline 0 N--CA 1.475 0.815 0 N-CA-C 115.024 1.49 . . . . 87.239999999999995 115.024 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -57.59 -20.3 41.18 Favored 'Trans proline' 0 C--N 1.356 0.973 0 N-CA-C 117.578 2.107 . . . . 93.150000000000006 117.578 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -81.41 -42.73 19.96 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.957 0.344 . . . . 95.060000000000002 111.563 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -179.22 -176.18 46.75 Favored Glycine 0 N--CA 1.465 0.587 0 CA-C-N 116.464 -0.335 . . . . 93.890000000000001 112.534 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.1 ttt-85 -70.52 146.41 50.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.697 0.284 . . . . 92.420000000000002 110.57 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.5 mt -115.1 121.3 66.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.652 -0.704 . . . . 86.560000000000002 109.483 -172.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -71.45 -41.52 69.33 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.276 0.36 . . . . 87.870000000000005 111.106 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -156.76 146.32 20.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.231 -0.44 . . . . 90.0 110.854 173.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -145.31 144.68 30.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 83.989999999999995 109.486 171.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.416 ' HA ' HG23 ' A' ' 13' ' ' THR . 7.7 ptt180 -161.58 158.67 26.64 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.538 0.94 . . . . 82.569999999999993 113.538 176.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -104.74 130.3 55.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 106.631 -1.618 . . . . 83.549999999999997 106.631 169.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.8 t -77.6 112.98 16.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 109.084 -0.71 . . . . 83.810000000000002 109.084 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -93.78 155.86 16.98 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.551 -0.537 . . . . 87.620000000000005 109.551 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.88 131.33 41.38 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 109.114 -0.698 . . . . 92.489999999999995 109.114 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . . . -62.4 -35.09 78.11 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.172 0.804 . . . . 93.340000000000003 113.172 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.45 -64.49 0.98 Allowed 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.141 0.276 . . . . 93.150000000000006 111.634 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 59.3 p -78.7 -48.52 14.8 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.835 0.68 . . . . 94.909999999999997 112.835 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 101.12 -5.72 56.08 Favored Glycine 0 N--CA 1.467 0.744 0 N-CA-C 114.619 0.608 . . . . 91.079999999999998 114.619 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . . . -72.08 160.39 32.56 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 117.211 0.505 . . . . 87.489999999999995 110.407 172.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.3 t -67.63 129.05 38.7 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.757 -0.656 . . . . 84.849999999999994 110.33 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . . . -67.72 -30.95 70.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.241 0.46 . . . . 83.430000000000007 112.241 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 131.06 -22.05 4.55 Favored Glycine 0 N--CA 1.466 0.683 0 N-CA-C 114.352 0.501 . . . . 80.120000000000005 114.352 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -130.23 170.47 14.05 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.392 0.516 . . . . 80.390000000000001 112.392 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.47 -178.9 28.46 Favored Glycine 0 N--CA 1.466 0.655 0 CA-C-N 115.619 -0.719 . . . . 71.299999999999997 113.291 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -132.57 148.51 52.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.177 0.591 . . . . 70.420000000000002 111.079 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.2 t -141.51 110.6 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.638 -0.875 . . . . 75.439999999999998 108.638 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.0 p -99.76 116.61 32.25 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 122.618 0.367 . . . . 83.400000000000006 111.586 -178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -93.0 157.97 16.04 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 122.96 0.504 . . . . 91.870000000000005 110.956 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -75.12 -47.62 27.74 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.881 -0.6 . . . . 93.879999999999995 110.648 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -89.88 150.77 22.06 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.689 0.796 . . . . 96.540000000000006 110.054 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -91.01 -39.43 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 111.73 0.271 . . . . 100.83 111.73 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -76.7 68.72 2.99 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 108.254 -1.017 . . . . 108.22 108.254 171.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.7 t0 178.89 -55.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.204 -1.036 . . . . 115.02 108.204 -162.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.29 75.42 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.173 -0.677 . . . . 102.94 109.173 167.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -50.7 -40.9 55.3 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.904 0.881 . . . . 106.20999999999999 113.017 171.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -67.37 -49.23 64.82 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.193 0.308 . . . . 107.73 111.32 171.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -33.32 68.45 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.299 1.222 . . . . 96.040000000000006 114.299 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -72.36 -47.76 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 122.347 0.259 . . . . 92.620000000000005 111.208 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -42.4 73.93 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.298 0.481 . . . . 102.89 112.298 -177.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.02 -40.29 62.98 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.947 0.721 . . . . 103.34 112.947 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 71.2 mmm -89.12 3.4 51.96 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.571 1.323 . . . . 93.620000000000005 114.571 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.0 85.28 0.17 Allowed Glycine 0 N--CA 1.467 0.728 0 CA-C-N 118.109 0.413 . . . . 96.670000000000002 113.853 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 101.92 10.8 39.08 Favored Glycine 0 N--CA 1.466 0.676 0 N-CA-C 115.619 1.008 . . . . 97.129999999999995 115.619 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -77.96 149.89 34.06 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 117.497 0.648 . . . . 97.390000000000001 110.513 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -79.01 134.03 36.8 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.013 -0.539 . . . . 93.090000000000003 111.174 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tt -150.09 111.3 4.4 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 108.658 -0.867 . . . . 91.459999999999994 108.658 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.2 38.57 92.05 Favored Glycine 0 N--CA 1.463 0.488 0 CA-C-N 116.225 -0.443 . . . . 91.480000000000004 113.097 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.77 27.24 73.21 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 115.777 1.071 . . . . 89.849999999999994 115.777 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -146.86 137.47 23.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.879 0.472 . . . . 92.480000000000004 110.959 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -74.78 139.97 43.69 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.3 -0.629 . . . . 86.140000000000001 109.3 172.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.8 pt -111.9 148.77 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 123.664 0.602 . . . . 80.069999999999993 111.939 -174.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -85.24 153.31 22.7 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.457 -0.942 . . . . 77.459999999999994 108.457 166.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 p -144.03 136.65 26.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.457 0.473 . . . . 76.760000000000005 110.882 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -167.09 178.27 5.78 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.649 -0.871 . . . . 79.849999999999994 108.649 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 97.8 m95 . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.904 0.859 . . . . 69.870000000000005 111.978 -177.576 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.523 -0.475 0 O4'-C1'-N19 110.084 1.884 . 0.0 '__' . 113.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' U' . . . . . 0.473 ' O2 ' " O4'" ' B' ' 2' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.42 0.479 0 N19-C1'-C2' 115.434 1.271 . 0.0 OUTLIER zeta-1 115.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.87 . . . . . . . . . . 0 0 . 1 stop_ save_