data_3e21_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 3e21 _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 ' 5' ' ' MET . . . . . . . . . . . . . 73.0 mtm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 112.111 0.411 . . . . 64.310000000000002 112.111 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.3 t0 59.07 76.98 0.33 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.96 -2.237 . . . . 34.829999999999998 104.96 -177.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -67.91 -23.33 65.09 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.116 -0.947 . . . . 26.559999999999999 112.815 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -64.46 -45.11 88.86 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.778 -0.823 . . . . 32.850000000000001 108.778 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 48.6 ttp -65.47 -42.65 92.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 33.009999999999998 110.367 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.1 mt -59.82 -44.07 93.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.016 -0.538 . . . . 19.989999999999998 109.55 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -64.47 -45.33 87.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.972 0.415 . . . . 16.760000000000002 110.397 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.39 -47.24 84.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.837 -0.431 . . . . 20.300000000000001 109.837 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -59.8 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 24.09 111.774 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.58 -45.94 87.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 18.489999999999998 111.63 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -66.11 -38.89 89.31 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.999 -0.68 . . . . 20.370000000000001 112.194 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.83 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.372 0.508 . . . . 21.34 112.372 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.0 t -89.04 -23.07 22.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 117.337 2.347 . . . . 53.68 117.337 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.5 p -102.34 -21.54 14.28 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 114.265 1.209 . . . . 21.760000000000002 114.265 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 81.68 6.67 88.9 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 119.699 -1.239 . . . . 21.0 112.008 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 96.6 mt -85.92 95.15 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 107.323 -1.362 . . . . 19.780000000000001 107.323 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -79.27 -17.18 55.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.704 1.742 . . . . 59.829999999999998 115.704 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.59 114.74 12.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.343 -0.984 . . . . 24.609999999999999 108.343 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.3 mt -60.12 -44.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 115.293 1.59 . . . . 29.989999999999998 115.293 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.16 -42.76 99.13 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 119.127 -1.029 . . . . 25.27 110.82 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -63.92 -42.81 97.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.057 -0.657 . . . . 30.710000000000001 110.057 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -42.86 99.88 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.883 0.373 . . . . 16.210000000000001 111.246 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.7 mt -66.05 -38.96 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.456 -0.498 . . . . 21.969999999999999 111.609 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.2 m -61.34 -45.01 96.21 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.307 -0.557 . . . . 23.699999999999999 109.72 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.46 -40.3 95.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 21.48 111.235 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.82 -39.15 90.59 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.445 -0.502 . . . . 19.699999999999999 110.922 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.71 -36.63 84.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.639 0.256 . . . . 32.640000000000001 110.935 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.4 -16.46 63.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.79 0.329 . . . . 34.890000000000001 111.192 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -111.43 19.53 18.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.161 -0.472 . . . . 24.359999999999999 111.045 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.6 t30 53.99 37.11 26.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.741 -0.663 . . . . 34.579999999999998 110.98 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 89.5 m95 56.12 23.43 6.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.131 1.16 . . . . 23.170000000000002 114.131 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -87.76 102.46 14.69 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.532 -2.396 . . . . 46.5 104.532 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.4 tp -51.18 -46.95 62.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.124 1.157 . . . . 27.100000000000001 114.124 -177.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . 0.435 ' CG1' ' N ' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -55.22 -46.33 77.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 C-N-CA 120.819 -0.352 . . . . 46.630000000000003 111.598 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . 0.435 ' N ' ' CG1' ' A' ' 38' ' ' VAL . . . -66.98 -44.74 79.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.545 0.572 . . . . 33.170000000000002 112.545 -179.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.088 0.403 . . . . 27.84 112.088 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 60.4 mt -63.5 -53.45 45.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 111.986 0.365 . . . . 34.579999999999998 111.986 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -71.68 17.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.182 0.515 . . . . 53.0 111.127 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -112.22 -9.69 19.43 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.211 -1.156 . . . . 42.659999999999997 110.211 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.111 -0.947 . . . . 45.159999999999997 109.762 179.655 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' MET . . . . . 0.695 ' HE1' HH21 ' A' ' 7' ' ' ARG . 73.0 mtm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 112.111 0.411 . . . . 64.31 112.111 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.3 t0 59.07 76.98 0.33 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.96 -2.237 . . . . 34.83 104.96 -177.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . 0.695 HH21 ' HE1' ' A' ' 5' ' ' MET . 99.6 mtt180 -67.91 -23.33 65.09 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.116 -0.947 . . . . 26.56 112.815 -178.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -64.46 -45.11 88.86 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.778 -0.823 . . . . 32.85 108.778 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 48.6 ttp -65.47 -42.65 92.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 33.01 110.367 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.1 mt -59.82 -44.07 93.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.016 -0.538 . . . . 19.99 109.55 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -64.47 -45.33 87.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.972 0.415 . . . . 16.76 110.397 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.39 -47.24 84.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.837 -0.431 . . . . 20.3 109.837 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -59.8 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 24.09 111.774 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.58 -45.94 87.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 18.49 111.63 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -66.11 -38.89 89.31 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.999 -0.68 . . . . 20.37 112.194 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.83 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.372 0.508 . . . . 21.34 112.372 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.0 t -89.04 -23.07 22.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 117.337 2.347 . . . . 53.68 117.337 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.5 p -102.34 -21.54 14.28 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 114.265 1.209 . . . . 21.76 114.265 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 81.68 6.67 88.9 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 119.699 -1.239 . . . . 21.0 112.008 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 96.6 mt -85.92 95.15 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 107.323 -1.362 . . . . 19.78 107.323 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -79.27 -17.18 55.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.704 1.742 . . . . 59.83 115.704 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -73.59 114.74 12.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.343 -0.984 . . . . 24.61 108.343 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.3 mt -60.12 -44.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 115.293 1.59 . . . . 29.99 115.293 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.16 -42.76 99.13 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 119.127 -1.029 . . . . 25.27 110.82 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -63.92 -42.81 97.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.057 -0.657 . . . . 30.71 110.057 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -42.86 99.88 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.883 0.373 . . . . 16.21 111.246 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.7 mt -66.05 -38.96 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.456 -0.498 . . . . 21.97 111.609 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.2 m -61.34 -45.01 96.21 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.307 -0.557 . . . . 23.7 109.72 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.46 -40.3 95.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 21.48 111.235 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.82 -39.15 90.59 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.445 -0.502 . . . . 19.7 110.922 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.71 -36.63 84.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.639 0.256 . . . . 32.64 110.935 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.4 -16.46 63.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.79 0.329 . . . . 34.89 111.192 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -111.43 19.53 18.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.161 -0.472 . . . . 24.36 111.045 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.6 t30 53.99 37.11 26.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.741 -0.663 . . . . 34.58 110.98 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 89.5 m95 56.12 23.43 6.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.131 1.16 . . . . 23.17 114.131 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -87.76 102.46 14.69 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.532 -2.396 . . . . 46.5 104.532 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.4 tp -51.18 -46.95 62.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.124 1.157 . . . . 27.1 114.124 -177.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -55.22 -46.33 77.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 C-N-CA 120.819 -0.352 . . . . 46.63 111.598 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . 0.472 ' N ' HG12 ' A' ' 38' ' ' VAL . . . -66.98 -44.74 79.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.545 0.572 . . . . 33.17 112.545 -179.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.088 0.403 . . . . 27.84 112.088 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . 0.463 ' C ' ' H ' ' A' ' 43' ' ' GLY . 60.4 mt -63.5 -53.45 45.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 111.986 0.365 . . . . 34.58 111.986 -179.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -71.68 17.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.182 0.515 . . . . 53.0 111.127 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -112.22 -9.69 19.43 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.211 -1.156 . . . . 42.66 110.211 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.111 -0.947 . . . . 45.16 109.762 179.655 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' MET . . . . . 0.695 ' HE1' HH21 ' A' ' 7' ' ' ARG . 73.0 mtm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 112.111 0.411 . . . . 64.31 112.111 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.3 t0 59.07 76.98 0.33 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.96 -2.237 . . . . 34.83 104.96 -177.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.695 HH21 ' HE1' ' A' ' 5' ' ' MET . 99.6 mtt180 -67.91 -23.33 65.09 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.116 -0.947 . . . . 26.56 112.815 -178.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -64.46 -45.11 88.86 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.778 -0.823 . . . . 32.85 108.778 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 48.6 ttp -65.47 -42.65 92.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 33.01 110.367 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.1 mt -59.82 -44.07 93.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.016 -0.538 . . . . 19.99 109.55 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -64.47 -45.33 87.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.972 0.415 . . . . 16.76 110.397 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.39 -47.24 84.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.837 -0.431 . . . . 20.3 109.837 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -59.8 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 24.09 111.774 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.58 -45.94 87.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 18.49 111.63 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -66.11 -38.89 89.31 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.999 -0.68 . . . . 20.37 112.194 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.83 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.372 0.508 . . . . 21.34 112.372 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.0 t -89.04 -23.07 22.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 117.337 2.347 . . . . 53.68 117.337 -177.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.5 p -102.34 -21.54 14.28 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 114.265 1.209 . . . . 21.76 114.265 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 81.68 6.67 88.9 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 119.699 -1.239 . . . . 21.0 112.008 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 96.6 mt -85.92 95.15 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 107.323 -1.362 . . . . 19.78 107.323 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -79.27 -17.18 55.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.704 1.742 . . . . 59.83 115.704 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.8 HD22 ' H ' ' A' ' 25' ' ' GLU . 1.9 t30 -73.59 114.74 12.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.343 -0.984 . . . . 24.61 108.343 178.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.3 mt -60.12 -44.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 115.293 1.59 . . . . 29.99 115.293 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.16 -42.76 99.13 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 119.127 -1.029 . . . . 25.27 110.82 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.8 ' H ' HD22 ' A' ' 22' ' ' ASN . 74.4 mm-40 -63.92 -42.81 97.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.057 -0.657 . . . . 30.71 110.057 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -42.86 99.88 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.883 0.373 . . . . 16.21 111.246 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.7 mt -66.05 -38.96 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.456 -0.498 . . . . 21.97 111.609 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.2 m -61.34 -45.01 96.21 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.307 -0.557 . . . . 23.7 109.72 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.8 mt -64.46 -40.3 95.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 21.48 111.235 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 mt -65.82 -39.15 90.59 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.445 -0.502 . . . . 19.7 110.922 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.71 -36.63 84.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.639 0.256 . . . . 32.64 110.935 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.4 -16.46 63.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.79 0.329 . . . . 34.89 111.192 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -111.43 19.53 18.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.161 -0.472 . . . . 24.36 111.045 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.6 t30 53.99 37.11 26.07 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.741 -0.663 . . . . 34.58 110.98 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 89.5 m95 56.12 23.43 6.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.131 1.16 . . . . 23.17 114.131 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -87.76 102.46 14.69 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.532 -2.396 . . . . 46.5 104.532 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 33.4 tp -51.18 -46.95 62.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.124 1.157 . . . . 27.1 114.124 -177.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -55.22 -46.33 77.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 C-N-CA 120.819 -0.352 . . . . 46.63 111.598 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.472 ' N ' HG12 ' A' ' 38' ' ' VAL . . . -66.98 -44.74 79.65 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.545 0.572 . . . . 33.17 112.545 -179.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.088 0.403 . . . . 27.84 112.088 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.463 ' C ' ' H ' ' A' ' 43' ' ' GLY . 60.4 mt -63.5 -53.45 45.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 111.986 0.365 . . . . 34.58 111.986 -179.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -71.68 17.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.182 0.515 . . . . 53.0 111.127 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -112.22 -9.69 19.43 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.211 -1.156 . . . . 42.66 110.211 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.111 -0.947 . . . . 45.16 109.762 179.655 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_