data_2fd9_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 2fd9 _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' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.123 0.487 . . . . 37.41 110.954 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 98.6 m -108.83 129.51 55.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 O-C-N 119.547 -1.971 . . . . 38.43 109.205 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 95.6 m -120.96 124.43 44.89 Favored 'General case' 0 CA--C 1.51 -0.574 0 O-C-N 120.595 -1.316 . . . . 35.34 107.703 -177.504 -68.935 -72.457 -86.794 108.101 2.043 118.219 -53.124 -66.638 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.1 m -118.73 136.64 24.29 Favored Pre-proline 0 C--O 1.221 -0.427 0 CA-C-N 120.021 1.282 . . . . 30.8 110.555 -172.799 -77.092 -63.185 105.056 110.007 2.036 110.151 -115.767 -61.48 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.49 -8.49 14.91 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 122.369 2.046 . . . . 28.31 113.993 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -157.77 164.19 37.31 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 119.409 -2.057 . . . . 27.88 108.729 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.5 mt -61.08 -46.98 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 120.613 -1.304 . . . . 28.97 108.707 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.55 -46.34 82.47 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 O-C-N 120.189 -1.569 . . . . 33.35 111.043 176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.47 -42.32 82.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.803 1.638 . . . . 26.91 111.172 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -63.26 -45.54 91.05 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 119.175 -2.203 . . . . 35.06 110.909 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.4 p -67.36 -43.09 82.34 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.843 -1.54 . . . . 29.58 106.843 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -55.75 -46.12 77.89 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.655 1.724 . . . . 24.34 115.655 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -61.74 -46.91 87.58 Favored 'General case' 0 N--CA 1.433 -1.29 0 C-N-CA 125.758 1.623 . . . . 29.62 109.085 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -58.9 -44.19 91.16 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 120.515 -1.365 . . . . 29.02 111.44 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -67.05 -41.08 86.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 119.292 -2.13 . . . . 27.3 109.223 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.34 -38.61 91.83 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 120.462 -1.398 . . . . 30.77 110.906 177.827 176.577 -90.238 -78.143 105.291 2.021 101.758 -62.544 -61.175 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -74.89 -9.87 58.96 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 120.03 -1.669 . . . . 40.01 114.604 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -57.48 14.69 Favored Pre-proline 0 N--CA 1.473 0.697 0 C-N-CA 126.563 1.945 . . . . 34.53 115.509 -174.341 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -58.62 -10.39 9.11 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 121.311 1.341 . . . . 37.8 114.213 173.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.8 29.58 9.1 Favored Glycine 0 C--N 1.332 0.329 0 N-CA-C 108.784 -1.726 . . . . 40.94 108.784 -174.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.8 m -71.76 138.91 82.92 Favored Pre-proline 0 C--O 1.222 -0.354 0 C-N-CA 125.558 1.543 . . . . 41.25 112.065 -174.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.19 138.47 6.88 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 O-C-N 122.096 0.524 . . . . 39.25 111.224 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -62.87 -34.45 77.4 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 120.816 -1.178 . . . . 42.21 112.016 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.59 -33.13 64.47 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 119.124 -2.235 . . . . 35.43 113.38 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.6 tp -60.19 -46.83 88.39 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.613 -1.93 . . . . 37.27 110.014 171.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.0 m -70.99 -36.8 72.62 Favored 'General case' 0 CA--C 1.49 -1.364 0 O-C-N 119.582 -1.949 . . . . 32.72 110.477 179.402 -61.175 -62.544 -78.143 101.758 2.021 105.291 -90.238 176.577 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.58 -47.41 85.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.398 -1.439 . . . . 31.49 108.775 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.7 m -63.39 -41.77 98.77 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.233 -1.542 . . . . 32.77 112.136 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.56 -38.14 88.92 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 119.842 -1.786 . . . . 27.35 111.544 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.1 p -101.4 -13.07 18.13 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.842 -1.786 . . . . 28.35 113.965 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 85.06 1.55 88.62 Favored Glycine 0 N--CA 1.47 0.965 0 O-C-N 118.584 -2.573 . . . . 32.25 112.812 -173.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.94 157.9 36.6 Favored 'General case' 0 N--CA 1.439 -1.013 0 O-C-N 119.2 -2.353 . . . . 33.28 108.693 173.356 -61.48 -115.767 105.056 110.151 2.036 110.007 -63.185 -77.092 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 pt -127.96 136.28 60.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 119.286 -2.134 . . . . 37.09 109.971 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.3 mt -97.65 128.84 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.543 -1.651 . . . . 39.22 106.543 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.22 143.33 47.84 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 120.452 -1.405 . . . . 40.13 111.364 -175.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -70.18 115.91 4.37 Favored 'Trans proline' 1 C--O 1.359 6.526 0 CA-C-O 117.826 -0.989 . . . . 39.63 111.541 175.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.23 116.22 1.99 Allowed Glycine 1 C--N 1.404 4.353 0 O-C-N 121.155 -0.965 . . . . 41.8 111.966 172.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.7 114.61 3.39 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.755 1.778 . . . . 44.81 113.892 -166.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.8 t -173.37 96.48 0.11 Allowed 'General case' 0 C--O 1.233 0.211 0 O-C-N 120.94 -1.1 . . . . 46.34 108.591 -175.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -98.76 152.73 37.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 119.353 -2.092 . . . . 46.75 111.573 -178.519 -66.638 -53.124 -86.794 118.219 2.043 108.101 -72.457 -68.935 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -82.1 -150.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.953 2.435 . . . . 51.03 115.224 -172.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.83 4.86 55.82 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.586 -1.321 . . . . 52.54 115.5 166.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.081 -1.835 . . . . 57.77 109.158 164.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.123 0.487 . . . . 37.409999999999997 110.954 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 0.422 HG21 ' CE1' ' A' ' 13' ' ' PHE . 98.6 m -108.83 129.51 55.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 O-C-N 119.547 -1.971 . . . . 38.43 109.205 176.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 95.6 m -120.96 124.43 44.89 Favored 'General case' 0 CA--C 1.51 -0.574 0 O-C-N 120.595 -1.316 . . . . 35.340000000000003 107.703 -177.504 -68.935 -72.457 -86.794 108.101 2.043 118.219 -53.124 -66.638 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.1 m -118.73 136.64 24.29 Favored Pre-proline 0 C--O 1.221 -0.427 0 CA-C-N 120.021 1.282 . . . . 30.800000000000001 110.555 -172.799 -77.092 -63.185 105.056 110.007 2.036 110.151 -115.767 -61.48 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.49 -8.49 14.91 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 122.369 2.046 . . . . 28.309999999999999 113.993 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -157.77 164.19 37.31 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 119.409 -2.057 . . . . 27.879999999999999 108.729 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.5 mt -61.08 -46.98 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 120.613 -1.304 . . . . 28.969999999999999 108.707 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 201' ' ' HOH . 1.2 t -56.55 -46.34 82.47 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 O-C-N 120.189 -1.569 . . . . 33.350000000000001 111.043 176.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.47 -42.32 82.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.803 1.638 . . . . 26.91 111.172 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -63.26 -45.54 91.05 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 119.175 -2.203 . . . . 35.060000000000002 110.909 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.4 p -67.36 -43.09 82.34 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.843 -1.54 . . . . 29.579999999999998 106.843 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -55.75 -46.12 77.89 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.655 1.724 . . . . 24.34 115.655 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . 0.422 ' CE1' HG21 ' A' ' 2' ' ' THR . 79.0 t80 -61.74 -46.91 87.58 Favored 'General case' 0 N--CA 1.433 -1.29 0 C-N-CA 125.758 1.623 . . . . 29.620000000000001 109.085 178.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -58.9 -44.19 91.16 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 120.515 -1.365 . . . . 29.02 111.44 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -67.05 -41.08 86.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 119.292 -2.13 . . . . 27.300000000000001 109.223 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.34 -38.61 91.83 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 120.462 -1.398 . . . . 30.77 110.906 177.827 176.577 -90.238 -78.143 105.291 2.021 101.758 -62.544 -61.175 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -74.89 -9.87 58.96 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 120.03 -1.669 . . . . 40.009999999999998 114.604 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -51.87 -57.48 14.69 Favored Pre-proline 0 N--CA 1.473 0.697 0 C-N-CA 126.563 1.945 . . . . 34.530000000000001 115.509 -174.341 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . 0.6 ' HG2' ' OG1' ' A' ' 21' ' ' THR . 9.9 Cg_endo -58.62 -10.39 9.11 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 121.311 1.341 . . . . 37.799999999999997 114.213 173.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.8 29.58 9.1 Favored Glycine 0 C--N 1.332 0.329 0 N-CA-C 108.784 -1.726 . . . . 40.939999999999998 108.784 -174.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . 0.6 ' OG1' ' HG2' ' A' ' 19' ' ' PRO . 12.8 m -71.76 138.91 82.92 Favored Pre-proline 0 C--O 1.222 -0.354 0 C-N-CA 125.558 1.543 . . . . 41.25 112.065 -174.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.19 138.47 6.88 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 O-C-N 122.096 0.524 . . . . 39.25 111.224 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -62.87 -34.45 77.4 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 120.816 -1.178 . . . . 42.210000000000001 112.016 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.59 -33.13 64.47 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 119.124 -2.235 . . . . 35.43 113.38 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.6 tp -60.19 -46.83 88.39 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.613 -1.93 . . . . 37.270000000000003 110.014 171.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.0 m -70.99 -36.8 72.62 Favored 'General case' 0 CA--C 1.49 -1.364 0 O-C-N 119.582 -1.949 . . . . 32.719999999999999 110.477 179.402 -61.175 -62.544 -78.143 101.758 2.021 105.291 -90.238 176.577 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.58 -47.41 85.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.398 -1.439 . . . . 31.489999999999998 108.775 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.7 m -63.39 -41.77 98.77 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.233 -1.542 . . . . 32.770000000000003 112.136 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.56 -38.14 88.92 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 119.842 -1.786 . . . . 27.350000000000001 111.544 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.1 p -101.4 -13.07 18.13 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.842 -1.786 . . . . 28.350000000000001 113.965 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 85.06 1.55 88.62 Favored Glycine 0 N--CA 1.47 0.965 0 O-C-N 118.584 -2.573 . . . . 32.25 112.812 -173.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.94 157.9 36.6 Favored 'General case' 0 N--CA 1.439 -1.013 0 O-C-N 119.2 -2.353 . . . . 33.280000000000001 108.693 173.356 -61.48 -115.767 105.056 110.151 2.036 110.007 -63.185 -77.092 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 pt -127.96 136.28 60.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 119.286 -2.134 . . . . 37.090000000000003 109.971 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.3 mt -97.65 128.84 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.543 -1.651 . . . . 39.219999999999999 106.543 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.22 143.33 47.84 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 120.452 -1.405 . . . . 40.130000000000003 111.364 -175.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -70.18 115.91 4.37 Favored 'Trans proline' 1 C--O 1.359 6.526 0 CA-C-O 117.826 -0.989 . . . . 39.630000000000003 111.541 175.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 39' ' ' THR . . . 91.23 116.22 1.99 Allowed Glycine 1 C--N 1.404 4.353 0 O-C-N 121.155 -0.965 . . . . 41.799999999999997 111.966 172.126 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.7 114.61 3.39 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.755 1.778 . . . . 44.810000000000002 113.892 -166.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 39' ' ' THR . 9.8 t -173.37 96.48 0.11 Allowed 'General case' 0 C--O 1.233 0.211 0 O-C-N 120.94 -1.1 . . . . 46.340000000000003 108.591 -175.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -98.76 152.73 37.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 119.353 -2.092 . . . . 46.75 111.573 -178.519 -66.638 -53.124 -86.794 118.219 2.043 108.101 -72.457 -68.935 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -82.1 -150.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.953 2.435 . . . . 51.030000000000001 115.224 -172.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.83 4.86 55.82 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.586 -1.321 . . . . 52.539999999999999 115.5 166.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.081 -1.835 . . . . 57.770000000000003 109.158 164.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.537 ' O ' HG23 ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.123 0.487 . . . . 37.409999999999997 110.954 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 0.422 HG21 ' CE1' ' A' ' 13' ' ' PHE . 98.6 m -108.83 129.51 55.39 Favored 'General case' 0 N--CA 1.438 -1.061 0 O-C-N 119.547 -1.971 . . . . 38.43 109.205 176.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 95.6 m -120.96 124.43 44.89 Favored 'General case' 0 CA--C 1.51 -0.574 0 O-C-N 120.595 -1.316 . . . . 35.340000000000003 107.703 -177.504 -68.935 -72.457 -86.794 108.101 2.043 118.219 -53.124 -66.638 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.1 m -118.73 136.64 24.29 Favored Pre-proline 0 C--O 1.221 -0.427 0 CA-C-N 120.021 1.282 . . . . 30.800000000000001 110.555 -172.799 -77.092 -63.185 105.056 110.007 2.036 110.151 -115.767 -61.48 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.49 -8.49 14.91 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 122.369 2.046 . . . . 28.309999999999999 113.993 -172.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -157.77 164.19 37.31 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 119.409 -2.057 . . . . 27.879999999999999 108.729 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.5 mt -61.08 -46.98 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 120.613 -1.304 . . . . 28.969999999999999 108.707 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 201' ' ' HOH . 1.2 t -56.55 -46.34 82.47 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 O-C-N 120.189 -1.569 . . . . 33.350000000000001 111.043 176.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.47 -42.32 82.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.803 1.638 . . . . 26.91 111.172 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -63.26 -45.54 91.05 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 119.175 -2.203 . . . . 35.060000000000002 110.909 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.4 p -67.36 -43.09 82.34 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.843 -1.54 . . . . 29.579999999999998 106.843 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -55.75 -46.12 77.89 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.655 1.724 . . . . 24.34 115.655 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.422 ' CE1' HG21 ' A' ' 2' ' ' THR . 79.0 t80 -61.74 -46.91 87.58 Favored 'General case' 0 N--CA 1.433 -1.29 0 C-N-CA 125.758 1.623 . . . . 29.620000000000001 109.085 178.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -58.9 -44.19 91.16 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 120.515 -1.365 . . . . 29.02 111.44 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . . . -67.05 -41.08 86.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 O-C-N 119.292 -2.13 . . . . 27.300000000000001 109.223 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.34 -38.61 91.83 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 120.462 -1.398 . . . . 30.77 110.906 177.827 176.577 -90.238 -78.143 105.291 2.021 101.758 -62.544 -61.175 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -74.89 -9.87 58.96 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 120.03 -1.669 . . . . 40.009999999999998 114.604 -177.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -51.87 -57.48 14.69 Favored Pre-proline 0 N--CA 1.473 0.697 0 C-N-CA 126.563 1.945 . . . . 34.530000000000001 115.509 -174.341 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.6 ' HG2' ' OG1' ' A' ' 21' ' ' THR . 9.9 Cg_endo -58.62 -10.39 9.11 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 121.311 1.341 . . . . 37.799999999999997 114.213 173.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 94.8 29.58 9.1 Favored Glycine 0 C--N 1.332 0.329 0 N-CA-C 108.784 -1.726 . . . . 40.939999999999998 108.784 -174.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . 0.6 ' OG1' ' HG2' ' A' ' 19' ' ' PRO . 12.8 m -71.76 138.91 82.92 Favored Pre-proline 0 C--O 1.222 -0.354 0 C-N-CA 125.558 1.543 . . . . 41.25 112.065 -174.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.19 138.47 6.88 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 O-C-N 122.096 0.524 . . . . 39.25 111.224 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -62.87 -34.45 77.4 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 120.816 -1.178 . . . . 42.210000000000001 112.016 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.59 -33.13 64.47 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 119.124 -2.235 . . . . 35.43 113.38 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.6 tp -60.19 -46.83 88.39 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 119.613 -1.93 . . . . 37.270000000000003 110.014 171.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.0 m -70.99 -36.8 72.62 Favored 'General case' 0 CA--C 1.49 -1.364 0 O-C-N 119.582 -1.949 . . . . 32.719999999999999 110.477 179.402 -61.175 -62.544 -78.143 101.758 2.021 105.291 -90.238 176.577 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.58 -47.41 85.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.398 -1.439 . . . . 31.489999999999998 108.775 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.7 m -63.39 -41.77 98.77 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.233 -1.542 . . . . 32.770000000000003 112.136 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.56 -38.14 88.92 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 119.842 -1.786 . . . . 27.350000000000001 111.544 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.1 p -101.4 -13.07 18.13 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.842 -1.786 . . . . 28.350000000000001 113.965 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 85.06 1.55 88.62 Favored Glycine 0 N--CA 1.47 0.965 0 O-C-N 118.584 -2.573 . . . . 32.25 112.812 -173.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.94 157.9 36.6 Favored 'General case' 0 N--CA 1.439 -1.013 0 O-C-N 119.2 -2.353 . . . . 33.280000000000001 108.693 173.356 -61.48 -115.767 105.056 110.151 2.036 110.007 -63.185 -77.092 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 pt -127.96 136.28 60.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 O-C-N 119.286 -2.134 . . . . 37.090000000000003 109.971 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.3 mt -97.65 128.84 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 N-CA-C 106.543 -1.651 . . . . 39.219999999999999 106.543 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 18.4 pt -133.22 143.33 47.84 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 120.452 -1.405 . . . . 40.130000000000003 111.364 -175.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -70.18 115.91 4.37 Favored 'Trans proline' 1 C--O 1.359 6.526 0 CA-C-O 117.826 -0.989 . . . . 39.630000000000003 111.541 175.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 39' ' ' THR . . . 91.23 116.22 1.99 Allowed Glycine 1 C--N 1.404 4.353 0 O-C-N 121.155 -0.965 . . . . 41.799999999999997 111.966 172.126 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.7 114.61 3.39 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.755 1.778 . . . . 44.810000000000002 113.892 -166.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.533 ' O ' HG23 ' A' ' 39' ' ' THR . 9.8 t -173.37 96.48 0.11 Allowed 'General case' 0 C--O 1.233 0.211 0 O-C-N 120.94 -1.1 . . . . 46.340000000000003 108.591 -175.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.9 m -98.76 152.73 37.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 119.353 -2.092 . . . . 46.75 111.573 -178.519 -66.638 -53.124 -86.794 118.219 2.043 108.101 -72.457 -68.935 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -82.1 -150.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.953 2.435 . . . . 51.030000000000001 115.224 -172.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.83 4.86 55.82 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.586 -1.321 . . . . 52.539999999999999 115.5 166.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.081 -1.835 . . . . 57.770000000000003 109.158 164.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.537 ' O ' HG23 ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_