data_2r9i_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 2r9i _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.799 0.333 . . . . 98.349999999999994 111.246 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASN . . . . . 0.429 ' C ' ' OD1' ' A' ' 2' ' ' ASN . 27.9 p30 -91.16 177.54 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 94.780000000000001 112.183 176.166 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.3 tp -57.93 -43.95 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 90.530000000000001 111.199 -167.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.64 -33.87 74.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.408 -0.59 . . . . 89.010000000000005 109.408 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.05 -39.72 63.32 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.915 0.886 . . . . 86.810000000000002 111.175 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.02 -38.28 85.51 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 124.217 0.948 . . . . 74.659999999999997 111.42 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.83 -41.35 68.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 119.465 -0.302 . . . . 68.799999999999997 110.36 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.19 -42.81 99.63 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-O 121.226 0.536 . . . . 64.299999999999997 110.273 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -60.67 -48.25 82.64 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 114.905 -1.043 . . . . 63.960000000000001 110.664 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -55.93 -47.69 77.06 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.278 0.561 . . . . 64.640000000000001 111.339 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -65.97 -37.33 85.71 Favored 'General case' 0 N--CA 1.427 -1.593 0 C-N-CA 120.572 -0.451 . . . . 85.019999999999996 111.683 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -60.12 -38.07 81.94 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 114.505 1.298 . . . . 68.359999999999999 114.505 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -36.45 79.16 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 116.073 -0.512 . . . . 67.709999999999994 110.759 177.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' MSE . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -42.45 64.28 Favored 'General case' 0 C--O 1.192 -1.932 0 N-CA-C 107.943 -1.132 . . . . 77.989999999999995 107.943 -177.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.47 -48.16 77.67 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.147 -0.933 . . . . 70.219999999999999 109.46 176.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.7 p -73.4 -28.43 62.0 Favored 'General case' 0 C--O 1.254 1.338 0 N-CA-C 114.716 1.376 . . . . 66.859999999999999 114.716 -175.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.21 -34.67 78.61 Favored 'General case' 0 C--O 1.242 0.662 0 O-C-N 123.884 0.74 . . . . 68.819999999999993 109.893 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -74.58 -44.32 51.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 114.164 1.172 . . . . 76.930000000000007 114.164 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -58.85 -37.2 75.96 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 106.547 -1.649 . . . . 86.390000000000001 106.547 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.18 88.22 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.409 -0.916 . . . . 71.829999999999998 113.347 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.267 0.0 OUTLIER -78.51 -26.53 45.9 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.248 -0.981 . . . . 80.689999999999998 112.356 -177.557 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.9 m -62.51 -35.25 78.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 76.209999999999994 111.18 172.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.64 64.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 75.629999999999995 111.184 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.2 mt -78.63 75.21 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 76.299999999999997 111.174 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . 0.46 ' OG1' ' OD2' ' A' ' 27' ' ' ASP . 35.0 p -86.82 154.06 21.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 77.370000000000005 111.205 169.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -78.68 11.36 2.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 78.810000000000002 111.189 -170.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . 0.46 ' OD2' ' OG1' ' A' ' 25' ' ' THR . 8.4 p-10 -102.8 10.84 38.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 78.030000000000001 111.187 167.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' MSE . . . . . . . . . . . . . 29.1 ttp -90.76 153.95 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 111.191 174.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.27 132.0 91.76 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.191 -0.459 . . . . 71.629999999999995 112.196 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -38.35 -44.37 2.04 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.401 3.401 . . . . 67.329999999999998 116.111 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.37 73.06 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.622 0.725 . . . . 68.299999999999997 111.39 -178.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.59 -39.11 93.15 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.034 -0.985 . . . . 78.939999999999998 111.19 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.43 -43.65 96.85 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.248 -0.581 . . . . 66.599999999999994 110.192 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.42 -41.22 98.53 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 123.432 0.458 . . . . 67.739999999999995 111.377 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -64.99 -48.93 72.22 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.937 -0.764 . . . . 80.829999999999998 108.937 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.67 -39.54 65.19 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.727 0.64 . . . . 71.299999999999997 112.727 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -65.98 -35.17 74.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.345 0.593 . . . . 72.430000000000007 111.214 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -62.49 -46.01 90.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.224 -0.658 . . . . 86.359999999999999 109.224 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -61.16 -41.64 97.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.167 1.173 . . . . 74.879999999999995 114.167 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 86.8 t -63.84 -45.16 97.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 120.246 -0.582 . . . . 74.040000000000006 111.968 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -56.11 -31.56 63.4 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 120.894 0.378 . . . . 78.689999999999998 111.973 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.52 -41.58 54.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.917 1.451 . . . . 68.810000000000002 114.917 178.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 85.8 mt -65.69 -46.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 107.562 -1.273 . . . . 66.930000000000007 107.562 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.289 0.5 OUTLIER -60.58 -36.36 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 117.342 -1.743 . . . . 71.400000000000006 112.097 179.39 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.0 t -58.02 -33.89 69.44 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 119.691 -0.804 . . . . 69.030000000000001 111.586 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -76.45 -37.3 57.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 113.113 0.783 . . . . 78.299999999999997 113.113 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 25.5 mt -54.48 -51.03 53.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 124.022 0.826 . . . . 68.700000000000003 110.192 170.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -57.81 -44.52 86.41 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 122.107 0.956 . . . . 82.150000000000006 111.371 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.0 t -67.56 -30.33 69.93 Favored 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 114.195 -1.366 . . . . 71.170000000000002 113.524 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.7 m -75.68 -35.75 60.26 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.399 -0.813 . . . . 67.469999999999999 109.353 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -56.53 -40.23 74.71 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 120.361 -0.536 . . . . 71.739999999999995 111.222 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -64.19 -42.69 96.55 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 120.609 -0.436 . . . . 85.359999999999999 111.718 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.8 80.47 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.258 0.551 . . . . 69.390000000000001 110.145 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.4 mt -67.25 -43.67 88.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.167 -0.47 . . . . 71.159999999999997 110.961 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.65 -45.77 91.29 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.877 0.471 . . . . 72.599999999999994 109.929 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.3 79.32 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.524 -0.274 . . . . 77.030000000000001 111.359 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.1 mtt-85 -64.48 -42.37 95.93 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 119.714 -0.794 . . . . 94.159999999999997 111.929 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -67.77 -48.82 65.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 118.226 0.466 . . . . 88.069999999999993 110.323 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.84 -45.74 85.23 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.281 -0.872 . . . . 81.829999999999998 114.682 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.33 -40.78 84.93 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 117.541 0.67 . . . . 82.459999999999994 112.096 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -77.43 -27.19 52.14 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 117.071 -1.851 . . . . 82.670000000000002 112.462 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -59.87 -43.28 94.82 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.596 0.713 . . . . 89.030000000000001 111.677 171.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.4 t -72.25 -50.53 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 CA-C-N 113.616 -1.629 . . . . 80.329999999999998 110.257 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 83.0 m -56.91 -37.48 71.5 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.752 -0.462 . . . . 80.510000000000005 109.752 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -75.91 -10.3 59.32 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 115.525 -0.761 . . . . 88.489999999999995 109.111 -173.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.8 -43.13 4.54 Favored 'General case' 0 C--O 1.199 -1.556 0 N-CA-C 107.524 -1.288 . . . . 82.739999999999995 107.524 -171.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . 0.466 ' O ' ' C ' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -44.44 -55.99 4.61 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 120.061 -0.655 . . . . 78.5 110.73 162.241 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' A' ' 67' ' ' LEU . 37.7 mttt -49.73 -49.66 47.11 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 105.999 -1.852 . . . . 81.75 105.999 -176.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -75.12 4.74 37.73 Favored Glycine 0 C--O 1.21 -1.363 0 N-CA-C 116.098 1.199 . . . . 77.060000000000002 116.098 -171.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.0 mt -118.0 6.55 12.16 Favored 'General case' 0 CA--C 1.48 -1.713 0 N-CA-C 106.843 -1.539 . . . . 76.859999999999999 106.843 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . 0.668 ' O ' ' CB ' ' A' ' 72' ' ' ILE . 2.2 m -80.23 140.17 36.38 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 118.811 -1.156 . . . . 83.390000000000001 112.365 -176.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . 0.668 ' CB ' ' O ' ' A' ' 71' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 113.675 0.991 . . . . 20.0 113.675 176.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.799 0.333 . . . . 98.35 111.246 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . 0.429 ' OD1' ' C ' ' A' ' 2' ' ' ASN . 27.9 p30 -91.16 177.54 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 94.78 112.183 176.166 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.3 tp -57.93 -43.95 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 90.53 111.199 -167.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.64 -33.87 74.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.408 -0.59 . . . . 89.01 109.408 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.05 -39.72 63.32 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.915 0.886 . . . . 86.81 111.175 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.869 HD12 ' HD2' ' A' ' 57' ' ' ARG . 10.2 mt -61.02 -38.28 85.51 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 124.217 0.948 . . . . 74.66 111.42 177.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.83 -41.35 68.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 119.465 -0.302 . . . . 68.8 110.36 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.19 -42.81 99.63 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-O 121.226 0.536 . . . . 64.3 110.273 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -60.67 -48.25 82.64 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 114.905 -1.043 . . . . 63.96 110.664 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 14' ' ' MSE . 4.0 tmt_? -55.93 -47.69 77.06 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.278 0.561 . . . . 64.64 111.339 176.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -65.97 -37.33 85.71 Favored 'General case' 0 N--CA 1.427 -1.593 0 C-N-CA 120.572 -0.451 . . . . 85.02 111.683 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -60.12 -38.07 81.94 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 114.505 1.298 . . . . 68.36 114.505 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -68.39 -36.45 79.16 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 116.073 -0.512 . . . . 67.71 110.759 177.016 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' MSE . . . . . 0.439 ' HG3' ' NH2' ' A' ' 10' ' ' ARG . 0.8 OUTLIER -72.67 -42.45 64.28 Favored 'General case' 0 C--O 1.192 -1.932 0 N-CA-C 107.943 -1.132 . . . . 77.99 107.943 -177.607 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.47 -48.16 77.67 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.147 -0.933 . . . . 70.22 109.46 176.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.7 p -73.4 -28.43 62.0 Favored 'General case' 0 C--O 1.254 1.338 0 N-CA-C 114.716 1.376 . . . . 66.86 114.716 -175.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.21 -34.67 78.61 Favored 'General case' 0 C--O 1.242 0.662 0 O-C-N 123.884 0.74 . . . . 68.82 109.893 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -74.58 -44.32 51.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 114.164 1.172 . . . . 76.93 114.164 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -58.85 -37.2 75.96 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 106.547 -1.649 . . . . 86.39 106.547 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.18 88.22 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.409 -0.916 . . . . 71.83 113.347 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.267 0.0 OUTLIER -78.51 -26.53 45.9 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.248 -0.981 . . . . 80.69 112.356 -177.557 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.9 m -62.51 -35.25 78.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 76.21 111.18 172.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.64 64.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 75.63 111.184 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . 0.627 ' HA ' ' CE ' ' A' ' 28' ' ' MSE . 40.2 mt -78.63 75.21 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 76.3 111.174 176.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.0 p -86.82 154.06 21.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 77.37 111.205 169.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -78.68 11.36 2.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 78.81 111.189 -170.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -102.8 10.84 38.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 78.03 111.187 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' MSE . . . . . 0.627 ' CE ' ' HA ' ' A' ' 24' ' ' ILE . 29.1 ttp -90.76 153.95 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.42 111.191 174.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.27 132.0 91.76 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.191 -0.459 . . . . 71.63 112.196 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -38.35 -44.37 2.04 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.401 3.401 . . . . 67.33 116.111 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.37 73.06 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.622 0.725 . . . . 68.3 111.39 -178.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.59 -39.11 93.15 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.034 -0.985 . . . . 78.94 111.19 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . 0.498 ' HA ' ' HE3' ' A' ' 28' ' ' MSE . . . -63.43 -43.65 96.85 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.248 -0.581 . . . . 66.6 110.192 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.42 -41.22 98.53 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 123.432 0.458 . . . . 67.74 111.377 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -64.99 -48.93 72.22 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.937 -0.764 . . . . 80.83 108.937 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.67 -39.54 65.19 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.727 0.64 . . . . 71.3 112.727 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -65.98 -35.17 74.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.345 0.593 . . . . 72.43 111.214 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -62.49 -46.01 90.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.224 -0.658 . . . . 86.36 109.224 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -61.16 -41.64 97.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.167 1.173 . . . . 74.88 114.167 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . 0.6 ' O ' HG23 ' A' ' 44' ' ' ILE . 86.8 t -63.84 -45.16 97.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 120.246 -0.582 . . . . 74.04 111.968 176.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -56.11 -31.56 63.4 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 120.894 0.378 . . . . 78.69 111.973 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.52 -41.58 54.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.917 1.451 . . . . 68.81 114.917 178.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 85.8 mt -65.69 -46.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 107.562 -1.273 . . . . 66.93 107.562 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 40' ' ' VAL 0.289 0.5 OUTLIER -60.58 -36.36 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 117.342 -1.743 . . . . 71.4 112.097 179.39 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.0 t -58.02 -33.89 69.44 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 119.691 -0.804 . . . . 69.03 111.586 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -76.45 -37.3 57.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 113.113 0.783 . . . . 78.3 113.113 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.527 HD12 ' HA ' ' A' ' 44' ' ' ILE . 25.5 mt -54.48 -51.03 53.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 124.022 0.826 . . . . 68.7 110.192 170.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -57.81 -44.52 86.41 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 122.107 0.956 . . . . 82.15 111.371 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.0 t -67.56 -30.33 69.93 Favored 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 114.195 -1.366 . . . . 71.17 113.524 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.7 m -75.68 -35.75 60.26 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.399 -0.813 . . . . 67.47 109.353 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -56.53 -40.23 74.71 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 120.361 -0.536 . . . . 71.74 111.222 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -64.19 -42.69 96.55 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 120.609 -0.436 . . . . 85.36 111.718 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.8 80.47 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.258 0.551 . . . . 69.39 110.145 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.4 mt -67.25 -43.67 88.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.167 -0.47 . . . . 71.16 110.961 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.65 -45.77 91.29 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.877 0.471 . . . . 72.6 109.929 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.3 79.32 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.524 -0.274 . . . . 77.03 111.359 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.869 ' HD2' HD12 ' A' ' 6' ' ' LEU . 96.1 mtt-85 -64.48 -42.37 95.93 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 119.714 -0.794 . . . . 94.16 111.929 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -67.77 -48.82 65.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 118.226 0.466 . . . . 88.07 110.323 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.84 -45.74 85.23 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.281 -0.872 . . . . 81.83 114.682 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.33 -40.78 84.93 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 117.541 0.67 . . . . 82.46 112.096 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -77.43 -27.19 52.14 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 117.071 -1.851 . . . . 82.67 112.462 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -59.87 -43.28 94.82 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.596 0.713 . . . . 89.03 111.677 171.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.4 t -72.25 -50.53 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 CA-C-N 113.616 -1.629 . . . . 80.33 110.257 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 83.0 m -56.91 -37.48 71.5 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.752 -0.462 . . . . 80.51 109.752 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -75.91 -10.3 59.32 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 115.525 -0.761 . . . . 88.49 109.111 -173.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . 0.417 ' HZ2' ' HG2' ' A' ' 66' ' ' LYS . 0.2 OUTLIER -107.8 -43.13 4.54 Favored 'General case' 0 C--O 1.199 -1.556 0 N-CA-C 107.524 -1.288 . . . . 82.74 107.524 -171.818 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.466 ' O ' ' C ' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -44.44 -55.99 4.61 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 120.061 -0.655 . . . . 78.5 110.73 162.241 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' A' ' 67' ' ' LEU . 37.7 mttt -49.73 -49.66 47.11 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 105.999 -1.852 . . . . 81.75 105.999 -176.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -75.12 4.74 37.73 Favored Glycine 0 C--O 1.21 -1.363 0 N-CA-C 116.098 1.199 . . . . 77.06 116.098 -171.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.0 mt -118.0 6.55 12.16 Favored 'General case' 0 CA--C 1.48 -1.713 0 N-CA-C 106.843 -1.539 . . . . 76.86 106.843 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . 1.046 ' O ' ' HB ' ' A' ' 72' ' ' ILE . 2.2 m -80.23 140.17 36.38 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 118.811 -1.156 . . . . 83.39 112.365 -176.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 1.046 ' HB ' ' O ' ' A' ' 71' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 113.675 0.991 . . . . 20.0 113.675 176.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.799 0.333 . . . . 98.349999999999994 111.246 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.429 ' C ' ' OD1' ' A' ' 2' ' ' ASN . 27.9 p30 -91.16 177.54 6.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 94.780000000000001 112.183 176.166 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 29.3 tp -57.93 -43.95 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 90.530000000000001 111.199 -167.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.64 -33.87 74.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.408 -0.59 . . . . 89.010000000000005 109.408 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.05 -39.72 63.32 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.915 0.886 . . . . 86.810000000000002 111.175 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.869 HD12 ' HD2' ' A' ' 57' ' ' ARG . 10.2 mt -61.02 -38.28 85.51 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 124.217 0.948 . . . . 74.659999999999997 111.42 177.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.83 -41.35 68.28 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 119.465 -0.302 . . . . 68.799999999999997 110.36 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.19 -42.81 99.63 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-O 121.226 0.536 . . . . 64.299999999999997 110.273 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -60.67 -48.25 82.64 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 114.905 -1.043 . . . . 63.960000000000001 110.664 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.439 ' NH2' ' HG3' ' A' ' 14' ' ' MSE . 4.0 tmt_? -55.93 -47.69 77.06 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.278 0.561 . . . . 64.640000000000001 111.339 176.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -65.97 -37.33 85.71 Favored 'General case' 0 N--CA 1.427 -1.593 0 C-N-CA 120.572 -0.451 . . . . 85.019999999999996 111.683 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -60.12 -38.07 81.94 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 114.505 1.298 . . . . 68.359999999999999 114.505 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -68.39 -36.45 79.16 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 116.073 -0.512 . . . . 67.709999999999994 110.759 177.016 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' MSE . . . . . 0.439 ' HG3' ' NH2' ' A' ' 10' ' ' ARG . 0.8 OUTLIER -72.67 -42.45 64.28 Favored 'General case' 0 C--O 1.192 -1.932 0 N-CA-C 107.943 -1.132 . . . . 77.989999999999995 107.943 -177.607 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -56.47 -48.16 77.67 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.147 -0.933 . . . . 70.219999999999999 109.46 176.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.7 p -73.4 -28.43 62.0 Favored 'General case' 0 C--O 1.254 1.338 0 N-CA-C 114.716 1.376 . . . . 66.859999999999999 114.716 -175.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.21 -34.67 78.61 Favored 'General case' 0 C--O 1.242 0.662 0 O-C-N 123.884 0.74 . . . . 68.819999999999993 109.893 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -74.58 -44.32 51.41 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 114.164 1.172 . . . . 76.930000000000007 114.164 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -58.85 -37.2 75.96 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 106.547 -1.649 . . . . 86.390000000000001 106.547 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.18 88.22 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.409 -0.916 . . . . 71.829999999999998 113.347 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.267 0.0 OUTLIER -78.51 -26.53 45.9 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 119.248 -0.981 . . . . 80.689999999999998 112.356 -177.557 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.9 m -62.51 -35.25 78.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 76.209999999999994 111.18 172.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.64 64.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 75.629999999999995 111.184 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.627 ' HA ' ' CE ' ' A' ' 28' ' ' MSE . 40.2 mt -78.63 75.21 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 76.299999999999997 111.174 176.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.0 p -86.82 154.06 21.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 77.370000000000005 111.205 169.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.5 p30 -78.68 11.36 2.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 78.810000000000002 111.189 -170.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -102.8 10.84 38.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 78.030000000000001 111.187 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' MSE . . . . . 0.627 ' CE ' ' HA ' ' A' ' 24' ' ' ILE . 29.1 ttp -90.76 153.95 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 111.191 174.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.27 132.0 91.76 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.191 -0.459 . . . . 71.629999999999995 112.196 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -38.35 -44.37 2.04 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 124.401 3.401 . . . . 67.329999999999998 116.111 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.84 -49.37 73.06 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.622 0.725 . . . . 68.299999999999997 111.39 -178.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.59 -39.11 93.15 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.034 -0.985 . . . . 78.939999999999998 111.19 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.498 ' HA ' ' HE3' ' A' ' 28' ' ' MSE . . . -63.43 -43.65 96.85 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 120.248 -0.581 . . . . 66.599999999999994 110.192 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.42 -41.22 98.53 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 123.432 0.458 . . . . 67.739999999999995 111.377 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.405 HE21 HD21 ' A' ' 39' ' ' ASN . 71.9 tp60 -64.99 -48.93 72.22 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.937 -0.764 . . . . 80.829999999999998 108.937 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.67 -39.54 65.19 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.727 0.64 . . . . 71.299999999999997 112.727 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -65.98 -35.17 74.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.345 0.593 . . . . 72.430000000000007 111.214 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -62.49 -46.01 90.42 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.224 -0.658 . . . . 86.359999999999999 109.224 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.405 HD21 HE21 ' A' ' 35' ' ' GLN . 6.4 m120 -61.16 -41.64 97.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.167 1.173 . . . . 74.879999999999995 114.167 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.6 ' O ' HG23 ' A' ' 44' ' ' ILE . 86.8 t -63.84 -45.16 97.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 120.246 -0.582 . . . . 74.040000000000006 111.968 176.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -56.11 -31.56 63.4 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 120.894 0.378 . . . . 78.689999999999998 111.973 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.52 -41.58 54.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.917 1.451 . . . . 68.810000000000002 114.917 178.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 85.8 mt -65.69 -46.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 107.562 -1.273 . . . . 66.930000000000007 107.562 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.6 HG23 ' O ' ' A' ' 40' ' ' VAL 0.289 0.5 OUTLIER -60.58 -36.36 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 117.342 -1.743 . . . . 71.400000000000006 112.097 179.39 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 10.0 t -58.02 -33.89 69.44 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 119.691 -0.804 . . . . 69.030000000000001 111.586 175.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -76.45 -37.3 57.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 113.113 0.783 . . . . 78.299999999999997 113.113 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.527 HD12 ' HA ' ' A' ' 44' ' ' ILE . 25.5 mt -54.48 -51.03 53.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 124.022 0.826 . . . . 68.700000000000003 110.192 170.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -57.81 -44.52 86.41 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 122.107 0.956 . . . . 82.150000000000006 111.371 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.0 t -67.56 -30.33 69.93 Favored 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 114.195 -1.366 . . . . 71.170000000000002 113.524 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.7 m -75.68 -35.75 60.26 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.399 -0.813 . . . . 67.469999999999999 109.353 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -56.53 -40.23 74.71 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 120.361 -0.536 . . . . 71.739999999999995 111.222 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -64.19 -42.69 96.55 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 120.609 -0.436 . . . . 85.359999999999999 111.718 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.8 80.47 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.258 0.551 . . . . 69.390000000000001 110.145 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.4 mt -67.25 -43.67 88.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-N 116.167 -0.47 . . . . 71.159999999999997 110.961 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.65 -45.77 91.29 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.877 0.471 . . . . 72.599999999999994 109.929 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.3 79.32 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.524 -0.274 . . . . 77.030000000000001 111.359 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.869 ' HD2' HD12 ' A' ' 6' ' ' LEU . 96.1 mtt-85 -64.48 -42.37 95.93 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 119.714 -0.794 . . . . 94.159999999999997 111.929 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -67.77 -48.82 65.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 118.226 0.466 . . . . 88.069999999999993 110.323 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.84 -45.74 85.23 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.281 -0.872 . . . . 81.829999999999998 114.682 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.33 -40.78 84.93 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 CA-C-N 117.541 0.67 . . . . 82.459999999999994 112.096 -176.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -77.43 -27.19 52.14 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 117.071 -1.851 . . . . 82.670000000000002 112.462 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -59.87 -43.28 94.82 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.596 0.713 . . . . 89.030000000000001 111.677 171.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.4 t -72.25 -50.53 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 CA-C-N 113.616 -1.629 . . . . 80.329999999999998 110.257 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 83.0 m -56.91 -37.48 71.5 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.752 -0.462 . . . . 80.510000000000005 109.752 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -75.91 -10.3 59.32 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 115.525 -0.761 . . . . 88.489999999999995 109.111 -173.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.417 ' HZ2' ' HG2' ' A' ' 66' ' ' LYS . 0.2 OUTLIER -107.8 -43.13 4.54 Favored 'General case' 0 C--O 1.199 -1.556 0 N-CA-C 107.524 -1.288 . . . . 82.739999999999995 107.524 -171.818 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.466 ' O ' ' C ' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -44.44 -55.99 4.61 Favored 'General case' 0 N--CA 1.423 -1.808 0 C-N-CA 120.061 -0.655 . . . . 78.5 110.73 162.241 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' A' ' 67' ' ' LEU . 37.7 mttt -49.73 -49.66 47.11 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 105.999 -1.852 . . . . 81.75 105.999 -176.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -75.12 4.74 37.73 Favored Glycine 0 C--O 1.21 -1.363 0 N-CA-C 116.098 1.199 . . . . 77.060000000000002 116.098 -171.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.0 mt -118.0 6.55 12.16 Favored 'General case' 0 CA--C 1.48 -1.713 0 N-CA-C 106.843 -1.539 . . . . 76.859999999999999 106.843 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . 1.046 ' O ' ' HB ' ' A' ' 72' ' ' ILE . 2.2 m -80.23 140.17 36.38 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 118.811 -1.156 . . . . 83.390000000000001 112.365 -176.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 1.046 ' HB ' ' O ' ' A' ' 71' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 113.675 0.991 . . . . 20.0 113.675 176.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_