data_1pen_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 1pen _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 109.767 -1.333 . . . . 11.53 109.767 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 36.5 t -46.23 -53.32 10.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 118.547 2.795 . . . . 7.78 118.547 -177.915 -171.672 70.614 -98.617 101.584 2.027 103.75 -90.448 -163.58 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.6 m -67.21 -14.16 62.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 118.248 2.685 . . . . 8.04 118.248 -174.982 -48.528 -51.875 -83.128 104.843 2.029 103.101 -62.623 -64.911 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.3 p -101.47 -4.58 26.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.751 -0.38 . . . . 9.47 110.062 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.9 tp -104.4 112.11 65.33 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.361 -0.978 . . . . 9.87 108.361 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -39.57 -56.26 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 N-CA-C 119.208 2.734 . . . . 7.88 119.208 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -59.78 -37.66 85.33 Favored 'Trans proline' 0 C--N 1.349 0.589 0 CA-C-N 118.657 0.556 . . . . 13.31 113.254 -179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 t -72.63 -46.15 55.47 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.096 0.776 . . . . 5.96 113.096 -178.995 -163.58 -90.448 -98.617 103.75 2.027 101.584 70.614 -171.672 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.03 -45.02 87.63 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.526 -0.306 . . . . 7.07 110.941 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.48 -30.75 71.57 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.235 0.828 . . . . 10.0 113.235 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -87.52 -7.72 57.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.437 0.903 . . . . 30.2 113.437 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -135.03 57.84 23.71 Favored Pre-proline 0 N--CA 1.455 -0.222 0 N-CA-C 111.97 0.359 . . . . 8.77 111.97 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -63.68 -26.5 68.72 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 120.763 0.975 . . . . 7.95 112.272 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.06 -37.09 86.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.067 0.395 . . . . 10.32 112.067 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -87.09 -46.38 9.84 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.039 0.755 . . . . 8.76 113.039 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.5 m -80.22 -22.05 42.21 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 115.608 1.707 . . . . 8.67 115.608 -177.697 -64.911 -62.623 -83.128 103.101 2.029 104.843 -51.875 -48.528 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.723 0 O-C-N 123.808 0.693 . . . . 5.72 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 109.767 -1.333 . . . . 11.529999999999999 109.767 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 36.5 t -46.23 -53.32 10.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 118.547 2.795 . . . . 7.7800000000000002 118.547 -177.915 -171.672 70.614 -98.617 101.584 2.027 103.75 -90.448 -163.58 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.6 m -67.21 -14.16 62.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 118.248 2.685 . . . . 8.0399999999999991 118.248 -174.982 -48.528 -51.875 -83.128 104.843 2.029 103.101 -62.623 -64.911 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.3 p -101.47 -4.58 26.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.751 -0.38 . . . . 9.4700000000000006 110.062 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.454 ' HG ' ' HD2' ' A' ' 7' ' ' PRO . 25.9 tp -104.4 112.11 65.33 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.361 -0.978 . . . . 9.8699999999999992 108.361 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . 0.555 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 38.7 Cg_exo -39.57 -56.26 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 N-CA-C 119.208 2.734 . . . . 7.8799999999999999 119.208 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . 0.555 ' HD3' ' HB2' ' A' ' 6' ' ' PRO . 50.9 Cg_exo -59.78 -37.66 85.33 Favored 'Trans proline' 0 C--N 1.349 0.589 0 CA-C-N 118.657 0.556 . . . . 13.31 113.254 -179.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 t -72.63 -46.15 55.47 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.096 0.776 . . . . 5.96 113.096 -178.995 -163.58 -90.448 -98.617 103.75 2.027 101.584 70.614 -171.672 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.03 -45.02 87.63 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.526 -0.306 . . . . 7.0700000000000003 110.941 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.48 -30.75 71.57 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.235 0.828 . . . . 10.0 113.235 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -87.52 -7.72 57.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.437 0.903 . . . . 30.199999999999999 113.437 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -135.03 57.84 23.71 Favored Pre-proline 0 N--CA 1.455 -0.222 0 N-CA-C 111.97 0.359 . . . . 8.7699999999999996 111.97 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -63.68 -26.5 68.72 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 120.763 0.975 . . . . 7.9500000000000002 112.272 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.06 -37.09 86.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.067 0.395 . . . . 10.32 112.067 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -87.09 -46.38 9.84 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.039 0.755 . . . . 8.7599999999999998 113.039 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.5 m -80.22 -22.05 42.21 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 115.608 1.707 . . . . 8.6699999999999999 115.608 -177.697 -64.911 -62.623 -83.128 103.101 2.029 104.843 -51.875 -48.528 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.723 0 O-C-N 123.808 0.693 . . . . 5.7199999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 109.767 -1.333 . . . . 11.529999999999999 109.767 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 36.5 t -46.23 -53.32 10.82 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 118.547 2.795 . . . . 7.7800000000000002 118.547 -177.915 -171.672 70.614 -98.617 101.584 2.027 103.75 -90.448 -163.58 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.6 m -67.21 -14.16 62.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 118.248 2.685 . . . . 8.0399999999999991 118.248 -174.982 -48.528 -51.875 -83.128 104.843 2.029 103.101 -62.623 -64.911 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.3 p -101.47 -4.58 26.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.751 -0.38 . . . . 9.4700000000000006 110.062 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.454 ' HG ' ' HD2' ' A' ' 7' ' ' PRO . 25.9 tp -104.4 112.11 65.33 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 108.361 -0.978 . . . . 9.8699999999999992 108.361 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.555 ' HB2' ' HD3' ' A' ' 7' ' ' PRO . 38.7 Cg_exo -39.57 -56.26 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 N-CA-C 119.208 2.734 . . . . 7.8799999999999999 119.208 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.555 ' HD3' ' HB2' ' A' ' 6' ' ' PRO . 50.9 Cg_exo -59.78 -37.66 85.33 Favored 'Trans proline' 0 C--N 1.349 0.589 0 CA-C-N 118.657 0.556 . . . . 13.31 113.254 -179.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 t -72.63 -46.15 55.47 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.096 0.776 . . . . 5.96 113.096 -178.995 -163.58 -90.448 -98.617 103.75 2.027 101.584 70.614 -171.672 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.03 -45.02 87.63 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.526 -0.306 . . . . 7.0700000000000003 110.941 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.48 -30.75 71.57 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.235 0.828 . . . . 10.0 113.235 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -87.52 -7.72 57.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.437 0.903 . . . . 30.199999999999999 113.437 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -135.03 57.84 23.71 Favored Pre-proline 0 N--CA 1.455 -0.222 0 N-CA-C 111.97 0.359 . . . . 8.7699999999999996 111.97 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -63.68 -26.5 68.72 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 120.763 0.975 . . . . 7.9500000000000002 112.272 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.06 -37.09 86.43 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.067 0.395 . . . . 10.32 112.067 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -87.09 -46.38 9.84 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.039 0.755 . . . . 8.7599999999999998 113.039 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.5 m -80.22 -22.05 42.21 Favored 'General case' 0 C--O 1.25 1.126 0 N-CA-C 115.608 1.707 . . . . 8.6699999999999999 115.608 -177.697 -64.911 -62.623 -83.128 103.101 2.029 104.843 -51.875 -48.528 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.723 0 O-C-N 123.808 0.693 . . . . 5.7199999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_