data_1ppt_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 1ppt _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 C--O 1.282 3.104 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -64.45 147.23 90.53 Favored 'Trans proline' 0 C--N 1.282 -2.96 0 CA-C-O 126.984 2.827 . . . . 0.0 108.47 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.9 p -76.08 156.03 34.24 Favored 'General case' 0 C--O 1.197 -1.685 0 CA-C-N 109.42 -3.537 . . . . 0.0 110.171 175.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.3 131.72 95.07 Favored Pre-proline 0 N--CA 1.504 2.264 0 CA-C-N 113.493 -1.685 . . . . 0.0 109.716 -170.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -68.88 150.47 73.49 Favored 'Trans proline' 0 N--CA 1.424 -2.596 0 C-N-CA 120.387 0.725 . . . . 0.0 110.821 -175.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -80.46 122.19 26.68 Favored 'General case' 0 N--CA 1.522 3.174 1 O-C-N 129.732 4.395 . . . . 0.0 109.63 173.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.04 120.86 67.76 Favored Pre-proline 0 N--CA 1.48 1.068 0 O-C-N 120.156 -1.59 . . . . 0.0 110.307 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.16 -4.73 15.49 Favored 'Trans proline' 1 C--O 1.341 5.627 0 C-N-CA 125.125 3.883 . . . . 0.0 114.855 -176.163 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 110.8 148.92 11.69 Favored Glycine 0 N--CA 1.5 2.94 0 N-CA-C 103.16 -3.976 . . . . 0.0 103.16 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -61.0 -32.48 72.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.611 -0.935 . . . . 0.0 111.59 171.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -97.63 20.66 11.49 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . 0.283 . . -79.62 146.57 65.46 Favored Pre-proline 0 N--CA 1.471 0.614 0 C-N-CA 112.996 -3.482 . . . . 0.0 110.416 176.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.51 153.07 43.65 Favored 'Trans proline' 1 C--O 1.367 6.943 0 C-N-CA 123.681 2.921 . . . . 0.0 109.746 -177.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -55.7 -28.39 23.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.078 0 O-C-N 121.162 -0.961 . . . . 0.0 112.555 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -71.61 -34.37 69.81 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-O 114.891 -2.48 . . . . 0.0 110.101 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -71.75 -30.08 65.2 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 126.964 2.665 . . . . 0.0 112.806 170.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . 0.327 45.9 mt -76.29 -24.97 54.43 Favored 'General case' 0 C--O 1.174 -2.91 1 O-C-N 115.679 -4.388 . . . . 0.0 111.028 172.715 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.7 mt -71.31 -42.88 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 115.536 -2.173 . . . . 0.0 107.474 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.11 -45.93 89.61 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 116.745 -1.982 . . . . 0.0 110.117 174.112 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -60.87 -43.83 97.87 Favored 'General case' 0 N--CA 1.442 -0.875 1 O-C-N 115.875 -4.266 . . . . 0.0 107.897 -177.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -54.65 -48.97 71.67 Favored 'General case' 0 N--CA 1.426 -1.63 0 O-C-N 118.67 -2.519 . . . . 0.0 108.317 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -64.92 -39.6 93.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 118.899 -1.12 . . . . 0.0 109.727 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -72.47 -36.04 68.37 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 115.428 -2.225 . . . . 0.0 106.537 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . 0.257 35.7 tp -65.8 -37.14 85.49 Favored 'General case' 1 N--CA 1.547 4.388 0 CA-C-O 115.429 -2.224 . . . . 0.0 107.018 -179.917 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -56.84 -51.38 69.24 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 119.971 1.259 . . . . 0.0 110.762 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -50.5 -57.33 8.34 Favored 'General case' 0 C--O 1.175 -2.851 0 CA-C-O 128.408 3.956 . . . . 0.0 111.023 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -55.33 -50.14 70.41 Favored 'General case' 0 C--N 1.36 1.034 1 O-C-N 114.424 -5.173 . . . . 0.0 110.652 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 55.5 mt -63.59 -42.94 98.24 Favored 'General case' 0 C--O 1.296 3.529 0 CA-C-O 114.543 -2.646 . . . . 0.0 110.584 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.45 -43.01 71.28 Favored 'General case' 0 N--CA 1.525 3.311 0 O-C-N 127.145 2.778 . . . . 0.0 111.248 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.08 -41.76 79.2 Favored 'Isoleucine or valine' 0 C--O 1.3 3.739 0 O-C-N 118.1 -2.875 . . . . 0.0 110.036 -174.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.308 42.6 t -66.3 -38.87 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 118.961 -2.337 . . . . 0.0 111.182 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.7 p -84.06 6.31 22.64 Favored 'General case' 0 C--O 1.268 2.073 0 O-C-N 117.225 -3.422 . . . . 0.0 112.197 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 52.0 mtp85 52.46 39.57 27.96 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-N 121.087 1.767 . . . . 0.0 110.426 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -133.32 74.74 1.58 Allowed 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.493 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.2 mtt180 -77.61 13.21 1.34 Allowed 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 114.205 -1.361 . . . . 0.0 111.002 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' TYR . . . . . 0.601 ' CD1' ' N ' ' A' ' 36' ' ' TYR 0.287 5.5 m-85 . . . . . 2 C--N 1.239 -4.202 1 O-C-N 114.658 -5.027 . . . . 0.0 107.586 152.764 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.282 3.104 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -64.45 147.23 90.53 Favored 'Trans proline' 0 C--N 1.282 -2.96 0 CA-C-O 126.984 2.827 . . . . 0.0 108.47 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.9 p -76.08 156.03 34.24 Favored 'General case' 0 C--O 1.197 -1.685 0 CA-C-N 109.42 -3.537 . . . . 0.0 110.171 175.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -65.3 131.72 95.07 Favored Pre-proline 0 N--CA 1.504 2.264 0 CA-C-N 113.493 -1.685 . . . . 0.0 109.716 -170.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -68.88 150.47 73.49 Favored 'Trans proline' 0 N--CA 1.424 -2.596 0 C-N-CA 120.387 0.725 . . . . 0.0 110.821 -175.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -80.46 122.19 26.68 Favored 'General case' 0 N--CA 1.522 3.174 1 O-C-N 129.732 4.395 . . . . 0.0 109.63 173.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.04 120.86 67.76 Favored Pre-proline 0 N--CA 1.48 1.068 0 O-C-N 120.156 -1.59 . . . . 0.0 110.307 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.16 -4.73 15.49 Favored 'Trans proline' 1 C--O 1.341 5.627 0 C-N-CA 125.125 3.883 . . . . 0.0 114.855 -176.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 110.8 148.92 11.69 Favored Glycine 0 N--CA 1.5 2.94 0 N-CA-C 103.16 -3.976 . . . . 0.0 103.16 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -61.0 -32.48 72.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.611 -0.935 . . . . 0.0 111.59 171.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -97.63 20.66 11.49 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . 0.283 . . -79.62 146.57 65.46 Favored Pre-proline 0 N--CA 1.471 0.614 0 C-N-CA 112.996 -3.482 . . . . 0.0 110.416 176.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.51 153.07 43.65 Favored 'Trans proline' 1 C--O 1.367 6.943 0 C-N-CA 123.681 2.921 . . . . 0.0 109.746 -177.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -55.7 -28.39 23.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.078 0 O-C-N 121.162 -0.961 . . . . 0.0 112.555 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 16' ' ' ASP . 7.1 pt-20 -71.61 -34.37 69.81 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-O 114.891 -2.48 . . . . 0.0 110.101 -177.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 86.8 m-20 -71.75 -30.08 65.2 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 126.964 2.665 . . . . 0.0 112.806 170.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . 0.327 45.9 mt -76.29 -24.97 54.43 Favored 'General case' 0 C--O 1.174 -2.91 1 O-C-N 115.679 -4.388 . . . . 0.0 111.028 172.715 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.7 mt -71.31 -42.88 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 115.536 -2.173 . . . . 0.0 107.474 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.11 -45.93 89.61 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 116.745 -1.982 . . . . 0.0 110.117 174.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -60.87 -43.83 97.87 Favored 'General case' 0 N--CA 1.442 -0.875 1 O-C-N 115.875 -4.266 . . . . 0.0 107.897 -177.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -54.65 -48.97 71.67 Favored 'General case' 0 N--CA 1.426 -1.63 0 O-C-N 118.67 -2.519 . . . . 0.0 108.317 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -64.92 -39.6 93.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 118.899 -1.12 . . . . 0.0 109.727 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -72.47 -36.04 68.37 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 115.428 -2.225 . . . . 0.0 106.537 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . 0.257 35.7 tp -65.8 -37.14 85.49 Favored 'General case' 1 N--CA 1.547 4.388 0 CA-C-O 115.429 -2.224 . . . . 0.0 107.018 -179.917 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -56.84 -51.38 69.24 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 119.971 1.259 . . . . 0.0 110.762 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -50.5 -57.33 8.34 Favored 'General case' 0 C--O 1.175 -2.851 0 CA-C-O 128.408 3.956 . . . . 0.0 111.023 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -55.33 -50.14 70.41 Favored 'General case' 0 C--N 1.36 1.034 1 O-C-N 114.424 -5.173 . . . . 0.0 110.652 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 55.5 mt -63.59 -42.94 98.24 Favored 'General case' 0 C--O 1.296 3.529 0 CA-C-O 114.543 -2.646 . . . . 0.0 110.584 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -54.45 -43.01 71.28 Favored 'General case' 0 N--CA 1.525 3.311 0 O-C-N 127.145 2.778 . . . . 0.0 111.248 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.08 -41.76 79.2 Favored 'Isoleucine or valine' 0 C--O 1.3 3.739 0 O-C-N 118.1 -2.875 . . . . 0.0 110.036 -174.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.308 42.6 t -66.3 -38.87 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 118.961 -2.337 . . . . 0.0 111.182 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.7 p -84.06 6.31 22.64 Favored 'General case' 0 C--O 1.268 2.073 0 O-C-N 117.225 -3.422 . . . . 0.0 112.197 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 52.0 mtp85 52.46 39.57 27.96 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-N 121.087 1.767 . . . . 0.0 110.426 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -133.32 74.74 1.58 Allowed 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.493 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.2 mtt180 -77.61 13.21 1.34 Allowed 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 114.205 -1.361 . . . . 0.0 111.002 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' TYR . . . . . 0.594 ' CD1' ' N ' ' A' ' 36' ' ' TYR 0.287 5.5 m-85 . . . . . 2 C--N 1.239 -4.202 1 O-C-N 114.658 -5.027 . . . . 0.0 107.586 152.764 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.282 3.104 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -64.45 147.23 90.53 Favored 'Trans proline' 0 C--N 1.282 -2.96 0 CA-C-O 126.984 2.827 . . . . 0.0 108.47 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.9 p -76.08 156.03 34.24 Favored 'General case' 0 C--O 1.197 -1.685 0 CA-C-N 109.42 -3.537 . . . . 0.0 110.171 175.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.3 131.72 95.07 Favored Pre-proline 0 N--CA 1.504 2.264 0 CA-C-N 113.493 -1.685 . . . . 0.0 109.716 -170.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -68.88 150.47 73.49 Favored 'Trans proline' 0 N--CA 1.424 -2.596 0 C-N-CA 120.387 0.725 . . . . 0.0 110.821 -175.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -80.46 122.19 26.68 Favored 'General case' 0 N--CA 1.522 3.174 1 O-C-N 129.732 4.395 . . . . 0.0 109.63 173.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.04 120.86 67.76 Favored Pre-proline 0 N--CA 1.48 1.068 0 O-C-N 120.156 -1.59 . . . . 0.0 110.307 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.16 -4.73 15.49 Favored 'Trans proline' 1 C--O 1.341 5.627 0 C-N-CA 125.125 3.883 . . . . 0.0 114.855 -176.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 110.8 148.92 11.69 Favored Glycine 0 N--CA 1.5 2.94 0 N-CA-C 103.16 -3.976 . . . . 0.0 103.16 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -61.0 -32.48 72.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.611 -0.935 . . . . 0.0 111.59 171.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -97.63 20.66 11.49 Favored 'General case' 0 C--N 1.288 -2.078 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . 0.283 . . -79.62 146.57 65.46 Favored Pre-proline 0 N--CA 1.471 0.614 0 C-N-CA 112.996 -3.482 . . . . 0.0 110.416 176.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.51 153.07 43.65 Favored 'Trans proline' 1 C--O 1.367 6.943 0 C-N-CA 123.681 2.921 . . . . 0.0 109.746 -177.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -55.7 -28.39 23.42 Favored 'Isoleucine or valine' 0 C--O 1.287 3.078 0 O-C-N 121.162 -0.961 . . . . 0.0 112.555 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 16' ' ' ASP . 7.1 pt-20 -71.61 -34.37 69.81 Favored 'General case' 0 C--N 1.273 -2.735 0 CA-C-O 114.891 -2.48 . . . . 0.0 110.101 -177.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 86.8 m-20 -71.75 -30.08 65.2 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 126.964 2.665 . . . . 0.0 112.806 170.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . 0.327 45.9 mt -76.29 -24.97 54.43 Favored 'General case' 0 C--O 1.174 -2.91 1 O-C-N 115.679 -4.388 . . . . 0.0 111.028 172.715 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.7 mt -71.31 -42.88 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 115.536 -2.173 . . . . 0.0 107.474 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.11 -45.93 89.61 Favored 'General case' 0 N--CA 1.518 2.942 0 C-N-CA 116.745 -1.982 . . . . 0.0 110.117 174.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -60.87 -43.83 97.87 Favored 'General case' 0 N--CA 1.442 -0.875 1 O-C-N 115.875 -4.266 . . . . 0.0 107.897 -177.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -54.65 -48.97 71.67 Favored 'General case' 0 N--CA 1.426 -1.63 0 O-C-N 118.67 -2.519 . . . . 0.0 108.317 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -64.92 -39.6 93.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 118.899 -1.12 . . . . 0.0 109.727 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -72.47 -36.04 68.37 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 115.428 -2.225 . . . . 0.0 106.537 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . 0.257 35.7 tp -65.8 -37.14 85.49 Favored 'General case' 1 N--CA 1.547 4.388 0 CA-C-O 115.429 -2.224 . . . . 0.0 107.018 -179.917 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -56.84 -51.38 69.24 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 119.971 1.259 . . . . 0.0 110.762 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -50.5 -57.33 8.34 Favored 'General case' 0 C--O 1.175 -2.851 0 CA-C-O 128.408 3.956 . . . . 0.0 111.023 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -55.33 -50.14 70.41 Favored 'General case' 0 C--N 1.36 1.034 1 O-C-N 114.424 -5.173 . . . . 0.0 110.652 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 55.5 mt -63.59 -42.94 98.24 Favored 'General case' 0 C--O 1.296 3.529 0 CA-C-O 114.543 -2.646 . . . . 0.0 110.584 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.45 -43.01 71.28 Favored 'General case' 0 N--CA 1.525 3.311 0 O-C-N 127.145 2.778 . . . . 0.0 111.248 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.08 -41.76 79.2 Favored 'Isoleucine or valine' 0 C--O 1.3 3.739 0 O-C-N 118.1 -2.875 . . . . 0.0 110.036 -174.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.308 42.6 t -66.3 -38.87 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 118.961 -2.337 . . . . 0.0 111.182 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.7 p -84.06 6.31 22.64 Favored 'General case' 0 C--O 1.268 2.073 0 O-C-N 117.225 -3.422 . . . . 0.0 112.197 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 52.0 mtp85 52.46 39.57 27.96 Favored 'General case' 0 C--N 1.273 -2.729 0 CA-C-N 121.087 1.767 . . . . 0.0 110.426 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -133.32 74.74 1.58 Allowed 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.493 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.2 mtt180 -77.61 13.21 1.34 Allowed 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 114.205 -1.361 . . . . 0.0 111.002 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.594 ' CD1' ' N ' ' A' ' 36' ' ' TYR 0.287 5.5 m-85 . . . . . 2 C--N 1.239 -4.202 1 O-C-N 114.658 -5.027 . . . . 0.0 107.586 152.764 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_