data_1ae2_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 1ae2 _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' ' ' MET . . . . . 0.922 ' N ' ' H2 ' ' A' ' 103' ' ' HOH . 5.5 ttt . . . . . 0 C--O 1.217 -0.621 0 CA-C-O 115.661 -2.114 . . . . 77.02 112.793 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.2 mt -91.99 125.03 44.68 Favored 'Isoleucine or valine' 0 C--O 1.246 0.895 1 CA-C-N 127.792 4.815 . . . . 39.21 107.24 174.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -84.58 116.86 23.38 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 123.226 0.329 . . . . 53.8 111.369 177.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 42.2 t -115.99 141.37 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 123.701 1.715 . . . . 30.46 110.361 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . 0.44 ' CD ' ' HZ1' ' A' ' 7' ' ' LYS . 74.0 tt0 -137.31 126.06 23.93 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 124.158 1.933 . . . . 42.5 114.72 -178.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.6 mm -98.46 105.22 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 CA-C-N 112.254 -2.248 . . . . 23.71 105.652 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . 0.812 ' H ' HE22 ' A' ' 10' ' ' GLN . 48.8 mmtt -67.66 150.99 97.56 Favored Pre-proline 0 N--CA 1.49 1.525 0 CA-C-O 115.736 -2.078 . . . . 29.24 112.948 174.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -53.83 -25.87 36.87 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 124.3 3.334 . . . . 19.53 111.996 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.4 p -79.12 -7.37 58.12 Favored 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.534 -2.603 . . . . 29.7 116.608 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . 0.812 HE22 ' H ' ' A' ' 7' ' ' LYS . 20.0 mt-30 -105.73 10.08 32.86 Favored 'General case' 0 C--N 1.35 0.615 0 N-CA-C 115.602 1.705 . . . . 31.36 115.602 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.23 3.07 7.77 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 119.396 3.11 . . . . 31.03 119.396 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -122.07 157.79 30.65 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.033 1.396 . . . . 67.7 111.238 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -117.37 167.33 11.35 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 125.931 2.777 . . . . 32.06 112.01 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 p -119.15 159.17 24.48 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 111.323 -2.671 . . . . 25.39 106.677 172.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . 0.613 ' HG1' ' ND2' ' A' ' 29' ' ' ASN . 76.3 m -120.76 119.03 31.56 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 125.798 1.936 . . . . 29.96 112.649 -176.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -97.61 149.27 22.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 125.664 2.649 . . . . 32.04 111.212 163.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . 0.434 ' HG ' ' N ' ' A' ' 18' ' ' GLY . 6.7 t -129.64 162.53 28.09 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.106 -2.77 . . . . 57.4 115.55 -174.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . 0.434 ' N ' ' HG ' ' A' ' 17' ' ' SER . . . 169.72 -163.94 37.42 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 117.766 1.866 . . . . 51.0 117.766 -178.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.7 t -134.83 127.48 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-O 123.825 1.774 . . . . 56.25 114.894 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.3 p -61.81 150.16 37.97 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 118.339 -2.725 . . . . 63.18 113.661 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtm105 -49.09 -26.43 2.69 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 117.434 2.383 . . . . 83.88 117.434 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.47 19.8 5.86 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 110.869 -2.878 . . . . 86.48 114.812 174.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.53 -37.48 3.33 Favored Glycine 0 CA--C 1.548 2.102 0 O-C-N 118.405 -2.685 . . . . 69.98 118.306 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -58.63 113.72 7.31 Favored Pre-proline 0 N--CA 1.474 0.737 2 O-C-N 115.933 -4.274 . . . . 68.54 119.124 -177.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.42 140.71 93.98 Favored 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 124.393 3.395 . . . . 60.53 118.138 170.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -125.31 171.32 10.5 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 119.886 -1.759 . . . . 42.6 113.874 176.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -153.93 115.21 4.12 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 114.913 1.449 . . . . 40.8 114.913 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.3 mt -98.31 125.8 43.56 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 114.655 1.354 . . . . 29.2 114.655 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . 0.613 ' ND2' ' HG1' ' A' ' 15' ' ' THR . 8.2 m120 -93.22 118.23 31.0 Favored 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 119.69 -1.881 . . . . 26.85 113.339 172.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.43 156.14 28.46 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 122.939 2.608 . . . . 53.39 116.891 173.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.254 57.7 tt0 -136.32 163.97 29.18 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 119.73 -1.856 . . . . 24.9 109.373 178.866 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.53 159.03 20.85 Favored 'General case' 0 CA--C 1.499 -0.983 0 O-C-N 118.939 -2.35 . . . . 60.41 108.957 179.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 p -161.1 173.89 14.51 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-O 124.118 1.913 . . . . 23.4 106.579 -176.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -115.28 134.53 55.04 Favored 'General case' 0 N--CA 1.423 -1.805 0 CA-C-N 112.85 -1.977 . . . . 35.02 109.765 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.0 t -121.9 125.85 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 CA-C-O 122.868 1.318 . . . . 21.47 108.256 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -81.58 104.52 12.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 124.705 2.193 . . . . 32.0 114.366 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.86 16.98 19.18 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 113.75 -1.568 . . . . 28.81 112.862 -178.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.94 17.53 80.21 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 114.862 -1.063 . . . . 30.76 114.676 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . 0.416 ' ND2' ' H ' ' A' ' 39' ' ' ASN . 0.0 OUTLIER -88.5 -173.26 4.09 Favored 'General case' 0 CA--C 1.568 1.635 0 O-C-N 120.244 -1.739 . . . . 43.94 111.205 176.536 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -55.22 -39.75 70.03 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 117.517 -3.239 . . . . 52.07 110.789 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -135.66 160.18 68.63 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 119.124 -2.235 . . . . 39.49 107.579 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -56.92 149.93 58.33 Favored 'Trans proline' 0 C--N 1.324 -0.739 0 C-N-CA 124.68 3.587 . . . . 27.16 115.75 167.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.2 m -99.09 159.92 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-O 122.83 1.3 . . . . 34.6 112.347 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -92.63 133.4 36.02 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 122.569 1.176 . . . . 34.35 109.586 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.8 t -130.68 137.9 54.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 114.026 -1.443 . . . . 21.31 113.626 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . 0.792 ' HZ3' ' H1 ' ' A' ' 121' ' ' HOH . 25.7 mttp -94.61 127.55 40.63 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.559 -1.338 . . . . 55.58 109.865 171.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.24 133.79 58.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 O-C-N 120.28 -1.513 . . . . 25.1 112.088 172.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.3 m -90.84 125.07 35.62 Favored 'General case' 0 C--N 1.361 1.103 0 CA-C-O 123.97 1.843 . . . . 31.96 109.915 169.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.94 155.85 36.97 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 113.402 -1.726 . . . . 29.66 109.393 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -81.29 155.84 25.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.713 -1.137 . . . . 36.59 110.074 175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -44.53 140.2 2.47 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.744 1.611 . . . . 73.76 111.355 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.88 1.37 39.22 Favored Glycine 0 CA--C 1.553 2.436 0 N-CA-C 118.164 2.026 . . . . 48.91 118.164 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.99 126.34 68.16 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 119.598 -2.119 . . . . 60.02 114.758 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.81 157.16 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.81 2.34 . . . . 45.48 110.042 166.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.76 146.33 13.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.395 -1.275 . . . . 33.42 112.254 170.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -70.31 130.63 42.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 O-C-N 120.386 -1.446 . . . . 28.93 109.502 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.27 156.76 74.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 O-C-N 119.946 -1.721 . . . . 32.06 112.707 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -51.72 140.53 46.5 Favored 'Trans proline' 0 C--N 1.356 0.963 0 CA-C-O 125.669 2.279 . . . . 34.89 112.242 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.99 -179.03 30.55 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 126.265 3.147 . . . . 25.55 111.402 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 70.7 mt -93.77 126.12 38.77 Favored 'General case' 0 C--O 1.249 1.063 1 CA-C-N 107.084 -4.558 . . . . 26.85 114.655 171.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -126.66 156.41 41.06 Favored 'General case' 0 N--CA 1.444 -0.765 1 CA-C-N 107.867 -4.242 . . . . 31.78 114.559 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.7 t -127.46 166.95 16.96 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 119.922 -1.737 . . . . 35.33 110.209 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . 0.493 ' CG1' ' HG ' ' A' ' 67' ' ' SER . 20.2 t -82.76 135.11 25.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 118.602 -2.561 . . . . 34.66 114.862 -175.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -84.56 144.09 28.88 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.752 -1.843 . . . . 31.41 109.508 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mt -53.98 -34.32 59.47 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 115.389 1.626 . . . . 32.0 115.389 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 93.5 p -59.4 -5.72 0.85 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 117.048 2.24 . . . . 32.99 117.048 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . 0.493 ' HG ' ' CG1' ' A' ' 63' ' ' VAL . 2.6 m -72.25 -20.92 61.46 Favored 'General case' 0 CA--C 1.494 -1.176 0 O-C-N 119.797 -1.814 . . . . 21.92 113.716 173.646 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -100.22 151.6 21.25 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 117.681 2.474 . . . . 24.45 117.681 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . 0.426 ' HZ2' ' CA ' ' A' ' 79' ' ' ASP . 17.8 pttm -155.23 163.16 40.55 Favored 'General case' 0 C--N 1.292 -1.91 0 O-C-N 117.808 -3.058 . . . . 64.32 108.962 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.6 t -89.85 132.41 34.61 Favored 'Isoleucine or valine' 0 C--N 1.361 1.09 0 N-CA-C 106.933 -1.506 . . . . 24.21 106.933 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.46 179.71 47.9 Favored Glycine 0 C--N 1.301 -1.41 0 O-C-N 119.628 -1.92 . . . . 24.35 113.049 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -70.48 -0.61 8.75 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 117.226 2.306 . . . . 46.32 117.226 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -111.93 16.34 20.37 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 122.902 2.592 . . . . 33.4 108.392 173.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.17 -4.5 62.36 Favored Glycine 0 N--CA 1.471 1.02 0 N-CA-C 118.96 2.344 . . . . 20.45 118.96 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 p -92.22 162.12 14.44 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 118.996 -2.473 . . . . 34.79 114.092 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.0 tp -73.73 131.22 41.37 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 119.83 -1.794 . . . . 20.08 109.065 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 18.8 ptm -126.69 168.58 14.17 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 121.024 -1.047 . . . . 46.63 113.745 171.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.52 132.09 36.02 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 O-C-N 116.814 -3.678 . . . . 21.68 109.128 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . 0.426 ' CA ' ' HZ2' ' A' ' 69' ' ' LYS . 21.4 t0 -81.36 -69.17 0.63 Allowed 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 113.066 -1.879 . . . . 34.23 110.141 175.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -143.66 131.71 21.74 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 102.794 -3.039 . . . . 48.14 102.794 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . 0.543 ' H ' ' H2 ' ' A' ' 97' ' ' HOH . 6.5 tp -66.36 113.28 4.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 121.431 1.923 . . . . 29.4 111.282 172.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 70.9 mtt85 -117.4 130.14 56.3 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 126.143 1.777 . . . . 27.61 106.56 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 38.6 mt -119.85 151.66 38.52 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 115.371 1.619 . . . . 24.28 115.371 -165.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 12.9 m -132.37 145.49 57.52 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-O 117.749 -1.12 . . . . 27.49 112.243 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -48.7 131.01 23.69 Favored 'Trans proline' 0 N--CA 1.442 -1.532 0 C-N-CA 123.769 2.979 . . . . 37.39 114.061 174.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 116.973 2.212 . . . . 52.25 116.973 179.445 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . 0.543 ' H2 ' ' H ' ' A' ' 81' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.922 ' H2 ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . 0.792 ' H1 ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.466 ' N ' ' O ' ' A' ' 103' ' ' HOH . 5.5 ttt . . . . . 0 C--O 1.217 -0.621 0 CA-C-O 115.661 -2.114 . . . . 77.02 112.793 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.2 mt -91.99 125.03 44.68 Favored 'Isoleucine or valine' 0 C--O 1.246 0.895 1 CA-C-N 127.792 4.815 . . . . 39.21 107.24 174.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -84.58 116.86 23.38 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 123.226 0.329 . . . . 53.8 111.369 177.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 42.2 t -115.99 141.37 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 123.701 1.715 . . . . 30.46 110.361 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -137.31 126.06 23.93 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 124.158 1.933 . . . . 42.5 114.72 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . 0.46 HD13 ' HB3' ' A' ' 33' ' ' CYS . 17.6 mm -98.46 105.22 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 CA-C-N 112.254 -2.248 . . . . 23.71 105.652 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -67.66 150.99 97.56 Favored Pre-proline 0 N--CA 1.49 1.525 0 CA-C-O 115.736 -2.078 . . . . 29.24 112.948 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -53.83 -25.87 36.87 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 124.3 3.334 . . . . 19.53 111.996 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.4 p -79.12 -7.37 58.12 Favored 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.534 -2.603 . . . . 29.7 116.608 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -105.73 10.08 32.86 Favored 'General case' 0 C--N 1.35 0.615 0 N-CA-C 115.602 1.705 . . . . 31.36 115.602 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.23 3.07 7.77 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 119.396 3.11 . . . . 31.03 119.396 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -122.07 157.79 30.65 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.033 1.396 . . . . 67.7 111.238 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . 0.542 ' HD2' ' HB2' ' A' ' 55' ' ' ALA . 52.4 p90 -117.37 167.33 11.35 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 125.931 2.777 . . . . 32.06 112.01 173.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 p -119.15 159.17 24.48 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 111.323 -2.671 . . . . 25.39 106.677 172.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.3 m -120.76 119.03 31.56 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 125.798 1.936 . . . . 29.96 112.649 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -97.61 149.27 22.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 125.664 2.649 . . . . 32.04 111.212 163.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.7 t -129.64 162.53 28.09 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.106 -2.77 . . . . 57.4 115.55 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.72 -163.94 37.42 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 117.766 1.866 . . . . 51.0 117.766 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.7 t -134.83 127.48 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-O 123.825 1.774 . . . . 56.25 114.894 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.3 p -61.81 150.16 37.97 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 118.339 -2.725 . . . . 63.18 113.661 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtm105 -49.09 -26.43 2.69 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 117.434 2.383 . . . . 83.88 117.434 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.47 19.8 5.86 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 110.869 -2.878 . . . . 86.48 114.812 174.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.53 -37.48 3.33 Favored Glycine 0 CA--C 1.548 2.102 0 O-C-N 118.405 -2.685 . . . . 69.98 118.306 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -58.63 113.72 7.31 Favored Pre-proline 0 N--CA 1.474 0.737 2 O-C-N 115.933 -4.274 . . . . 68.54 119.124 -177.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.42 140.71 93.98 Favored 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 124.393 3.395 . . . . 60.53 118.138 170.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -125.31 171.32 10.5 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 119.886 -1.759 . . . . 42.6 113.874 176.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -153.93 115.21 4.12 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 114.913 1.449 . . . . 40.8 114.913 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.3 mt -98.31 125.8 43.56 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 114.655 1.354 . . . . 29.2 114.655 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -93.22 118.23 31.0 Favored 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 119.69 -1.881 . . . . 26.85 113.339 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.43 156.14 28.46 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 122.939 2.608 . . . . 53.39 116.891 173.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.254 57.7 tt0 -136.32 163.97 29.18 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 119.73 -1.856 . . . . 24.9 109.373 178.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HG2' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -114.53 159.03 20.85 Favored 'General case' 0 CA--C 1.499 -0.983 0 O-C-N 118.939 -2.35 . . . . 60.41 108.957 179.709 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HB3' HD13 ' A' ' 6' ' ' ILE . 21.7 p -161.1 173.89 14.51 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-O 124.118 1.913 . . . . 23.4 106.579 -176.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -115.28 134.53 55.04 Favored 'General case' 0 N--CA 1.423 -1.805 0 CA-C-N 112.85 -1.977 . . . . 35.02 109.765 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.486 HG12 HD13 ' A' ' 37' ' ' LEU . 65.0 t -121.9 125.85 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 CA-C-O 122.868 1.318 . . . . 21.47 108.256 -178.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -81.58 104.52 12.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 124.705 2.193 . . . . 32.0 114.366 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.486 HD13 HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -97.86 16.98 19.18 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 113.75 -1.568 . . . . 28.81 112.862 -178.627 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.94 17.53 80.21 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 114.862 -1.063 . . . . 30.76 114.676 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.5 -173.26 4.09 Favored 'General case' 0 CA--C 1.568 1.635 0 O-C-N 120.244 -1.739 . . . . 43.94 111.205 176.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -55.22 -39.75 70.03 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 117.517 -3.239 . . . . 52.07 110.789 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -135.66 160.18 68.63 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 119.124 -2.235 . . . . 39.49 107.579 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -56.92 149.93 58.33 Favored 'Trans proline' 0 C--N 1.324 -0.739 0 C-N-CA 124.68 3.587 . . . . 27.16 115.75 167.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.2 m -99.09 159.92 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-O 122.83 1.3 . . . . 34.6 112.347 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.507 HD21 ' HG2' ' A' ' 32' ' ' ARG . 1.4 tm? -92.63 133.4 36.02 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 122.569 1.176 . . . . 34.35 109.586 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.8 t -130.68 137.9 54.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 114.026 -1.443 . . . . 21.31 113.626 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.61 127.55 40.63 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.559 -1.338 . . . . 55.58 109.865 171.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.24 133.79 58.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 O-C-N 120.28 -1.513 . . . . 25.1 112.088 172.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.3 m -90.84 125.07 35.62 Favored 'General case' 0 C--N 1.361 1.103 0 CA-C-O 123.97 1.843 . . . . 31.96 109.915 169.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.94 155.85 36.97 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 113.402 -1.726 . . . . 29.66 109.393 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 53' ' ' GLN . 63.3 m-20 -81.29 155.84 25.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.713 -1.137 . . . . 36.59 110.074 175.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -44.53 140.2 2.47 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.744 1.611 . . . . 73.76 111.355 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.88 1.37 39.22 Favored Glycine 0 CA--C 1.553 2.436 0 N-CA-C 118.164 2.026 . . . . 48.91 118.164 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' ASP . 3.1 mt-30 -84.99 126.34 68.16 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 119.598 -2.119 . . . . 60.02 114.758 177.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.81 157.16 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.81 2.34 . . . . 45.48 110.042 166.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 13' ' ' PHE . . . -53.76 146.33 13.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.395 -1.275 . . . . 33.42 112.254 170.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -70.31 130.63 42.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 O-C-N 120.386 -1.446 . . . . 28.93 109.502 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.27 156.76 74.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 O-C-N 119.946 -1.721 . . . . 32.06 112.707 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -51.72 140.53 46.5 Favored 'Trans proline' 0 C--N 1.356 0.963 0 CA-C-O 125.669 2.279 . . . . 34.89 112.242 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.99 -179.03 30.55 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 126.265 3.147 . . . . 25.55 111.402 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 70.7 mt -93.77 126.12 38.77 Favored 'General case' 0 C--O 1.249 1.063 1 CA-C-N 107.084 -4.558 . . . . 26.85 114.655 171.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -126.66 156.41 41.06 Favored 'General case' 0 N--CA 1.444 -0.765 1 CA-C-N 107.867 -4.242 . . . . 31.78 114.559 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.7 t -127.46 166.95 16.96 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 119.922 -1.737 . . . . 35.33 110.209 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.2 t -82.76 135.11 25.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 118.602 -2.561 . . . . 34.66 114.862 -175.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -84.56 144.09 28.88 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.752 -1.843 . . . . 31.41 109.508 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mt -53.98 -34.32 59.47 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 115.389 1.626 . . . . 32.0 115.389 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 93.5 p -59.4 -5.72 0.85 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 117.048 2.24 . . . . 32.99 117.048 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 m -72.25 -20.92 61.46 Favored 'General case' 0 CA--C 1.494 -1.176 0 O-C-N 119.797 -1.814 . . . . 21.92 113.716 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -100.22 151.6 21.25 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 117.681 2.474 . . . . 24.45 117.681 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . 0.54 ' HZ3' ' HA ' ' A' ' 79' ' ' ASP . 17.8 pttm -155.23 163.16 40.55 Favored 'General case' 0 C--N 1.292 -1.91 0 O-C-N 117.808 -3.058 . . . . 64.32 108.962 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.6 t -89.85 132.41 34.61 Favored 'Isoleucine or valine' 0 C--N 1.361 1.09 0 N-CA-C 106.933 -1.506 . . . . 24.21 106.933 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.46 179.71 47.9 Favored Glycine 0 C--N 1.301 -1.41 0 O-C-N 119.628 -1.92 . . . . 24.35 113.049 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -70.48 -0.61 8.75 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 117.226 2.306 . . . . 46.32 117.226 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -111.93 16.34 20.37 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 122.902 2.592 . . . . 33.4 108.392 173.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.17 -4.5 62.36 Favored Glycine 0 N--CA 1.471 1.02 0 N-CA-C 118.96 2.344 . . . . 20.45 118.96 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 p -92.22 162.12 14.44 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 118.996 -2.473 . . . . 34.79 114.092 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.0 tp -73.73 131.22 41.37 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 119.83 -1.794 . . . . 20.08 109.065 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' MET . . . . . 0.458 ' SD ' ' HE2' ' A' ' 69' ' ' LYS . 18.8 ptm -126.69 168.58 14.17 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 121.024 -1.047 . . . . 46.63 113.745 171.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.52 132.09 36.02 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 O-C-N 116.814 -3.678 . . . . 21.68 109.128 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . 0.54 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 21.4 t0 -81.36 -69.17 0.63 Allowed 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 113.066 -1.879 . . . . 34.23 110.141 175.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -143.66 131.71 21.74 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 102.794 -3.039 . . . . 48.14 102.794 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.36 113.28 4.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 121.431 1.923 . . . . 29.4 111.282 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 70.9 mtt85 -117.4 130.14 56.3 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 126.143 1.777 . . . . 27.61 106.56 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 38.6 mt -119.85 151.66 38.52 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 115.371 1.619 . . . . 24.28 115.371 -165.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 12.9 m -132.37 145.49 57.52 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-O 117.749 -1.12 . . . . 27.49 112.243 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -48.7 131.01 23.69 Favored 'Trans proline' 0 N--CA 1.442 -1.532 0 C-N-CA 123.769 2.979 . . . . 37.39 114.061 174.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 116.973 2.212 . . . . 52.25 116.973 179.445 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.466 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.466 ' N ' ' O ' ' A' ' 103' ' ' HOH . 5.5 ttt . . . . . 0 C--O 1.217 -0.621 0 CA-C-O 115.661 -2.114 . . . . 77.019999999999996 112.793 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.2 mt -91.99 125.03 44.68 Favored 'Isoleucine or valine' 0 C--O 1.246 0.895 1 CA-C-N 127.792 4.815 . . . . 39.210000000000001 107.24 174.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -84.58 116.86 23.38 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 123.226 0.329 . . . . 53.799999999999997 111.369 177.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 42.2 t -115.99 141.37 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 123.701 1.715 . . . . 30.460000000000001 110.361 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -137.31 126.06 23.93 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 124.158 1.933 . . . . 42.5 114.72 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.46 HD13 ' HB3' ' A' ' 33' ' ' CYS . 17.6 mm -98.46 105.22 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 CA-C-N 112.254 -2.248 . . . . 23.710000000000001 105.652 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.66 ' H ' HE21 ' A' ' 10' ' ' GLN . 48.8 mmtt -67.66 150.99 97.56 Favored Pre-proline 0 N--CA 1.49 1.525 0 CA-C-O 115.736 -2.078 . . . . 29.239999999999998 112.948 174.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -53.83 -25.87 36.87 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 124.3 3.334 . . . . 19.530000000000001 111.996 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.4 p -79.12 -7.37 58.12 Favored 'General case' 0 N--CA 1.482 1.153 0 O-C-N 118.534 -2.603 . . . . 29.699999999999999 116.608 175.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.66 HE21 ' H ' ' A' ' 7' ' ' LYS . 20.0 mt-30 -105.73 10.08 32.86 Favored 'General case' 0 C--N 1.35 0.615 0 N-CA-C 115.602 1.705 . . . . 31.359999999999999 115.602 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.23 3.07 7.77 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 119.396 3.11 . . . . 31.030000000000001 119.396 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -122.07 157.79 30.65 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.033 1.396 . . . . 67.700000000000003 111.238 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.542 ' HD2' ' HB2' ' A' ' 55' ' ' ALA . 52.4 p90 -117.37 167.33 11.35 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 125.931 2.777 . . . . 32.060000000000002 112.01 173.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.8 p -119.15 159.17 24.48 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 111.323 -2.671 . . . . 25.390000000000001 106.677 172.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.3 m -120.76 119.03 31.56 Favored 'General case' 0 CA--C 1.504 -0.821 0 O-C-N 125.798 1.936 . . . . 29.960000000000001 112.649 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -97.61 149.27 22.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 125.664 2.649 . . . . 32.039999999999999 111.212 163.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.7 t -129.64 162.53 28.09 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.106 -2.77 . . . . 57.399999999999999 115.55 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.72 -163.94 37.42 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 117.766 1.866 . . . . 51.0 117.766 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.7 t -134.83 127.48 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-O 123.825 1.774 . . . . 56.25 114.894 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 96.3 p -61.81 150.16 37.97 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 118.339 -2.725 . . . . 63.18 113.661 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtm105 -49.09 -26.43 2.69 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 117.434 2.383 . . . . 83.879999999999995 117.434 -177.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.47 19.8 5.86 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 110.869 -2.878 . . . . 86.480000000000004 114.812 174.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.53 -37.48 3.33 Favored Glycine 0 CA--C 1.548 2.102 0 O-C-N 118.405 -2.685 . . . . 69.980000000000004 118.306 -177.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -58.63 113.72 7.31 Favored Pre-proline 0 N--CA 1.474 0.737 2 O-C-N 115.933 -4.274 . . . . 68.540000000000006 119.124 -177.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.42 140.71 93.98 Favored 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 124.393 3.395 . . . . 60.530000000000001 118.138 170.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -125.31 171.32 10.5 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 119.886 -1.759 . . . . 42.600000000000001 113.874 176.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -153.93 115.21 4.12 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 114.913 1.449 . . . . 40.799999999999997 114.913 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.3 mt -98.31 125.8 43.56 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 114.655 1.354 . . . . 29.199999999999999 114.655 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -93.22 118.23 31.0 Favored 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 119.69 -1.881 . . . . 26.850000000000001 113.339 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.43 156.14 28.46 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 122.939 2.608 . . . . 53.390000000000001 116.891 173.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.254 57.7 tt0 -136.32 163.97 29.18 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 119.73 -1.856 . . . . 24.899999999999999 109.373 178.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HG2' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -114.53 159.03 20.85 Favored 'General case' 0 CA--C 1.499 -0.983 0 O-C-N 118.939 -2.35 . . . . 60.409999999999997 108.957 179.709 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HB3' HD13 ' A' ' 6' ' ' ILE . 21.7 p -161.1 173.89 14.51 Favored 'General case' 0 CA--C 1.493 -1.223 0 CA-C-O 124.118 1.913 . . . . 23.399999999999999 106.579 -176.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -115.28 134.53 55.04 Favored 'General case' 0 N--CA 1.423 -1.805 0 CA-C-N 112.85 -1.977 . . . . 35.020000000000003 109.765 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.486 HG12 HD13 ' A' ' 37' ' ' LEU . 65.0 t -121.9 125.85 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 CA-C-O 122.868 1.318 . . . . 21.469999999999999 108.256 -178.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -81.58 104.52 12.05 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 124.705 2.193 . . . . 32.0 114.366 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.486 HD13 HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -97.86 16.98 19.18 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 113.75 -1.568 . . . . 28.809999999999999 112.862 -178.627 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.94 17.53 80.21 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 114.862 -1.063 . . . . 30.760000000000002 114.676 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -88.5 -173.26 4.09 Favored 'General case' 0 CA--C 1.568 1.635 0 O-C-N 120.244 -1.739 . . . . 43.939999999999998 111.205 176.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -55.22 -39.75 70.03 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 117.517 -3.239 . . . . 52.07 110.789 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -135.66 160.18 68.63 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 119.124 -2.235 . . . . 39.490000000000002 107.579 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -56.92 149.93 58.33 Favored 'Trans proline' 0 C--N 1.324 -0.739 0 C-N-CA 124.68 3.587 . . . . 27.16 115.75 167.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.2 m -99.09 159.92 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-O 122.83 1.3 . . . . 34.600000000000001 112.347 176.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.507 HD21 ' HG2' ' A' ' 32' ' ' ARG . 1.4 tm? -92.63 133.4 36.02 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 122.569 1.176 . . . . 34.350000000000001 109.586 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.8 t -130.68 137.9 54.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 114.026 -1.443 . . . . 21.309999999999999 113.626 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.61 127.55 40.63 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.559 -1.338 . . . . 55.579999999999998 109.865 171.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.24 133.79 58.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 O-C-N 120.28 -1.513 . . . . 25.100000000000001 112.088 172.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.3 m -90.84 125.07 35.62 Favored 'General case' 0 C--N 1.361 1.103 0 CA-C-O 123.97 1.843 . . . . 31.960000000000001 109.915 169.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.94 155.85 36.97 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 113.402 -1.726 . . . . 29.66 109.393 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 53' ' ' GLN . 63.3 m-20 -81.29 155.84 25.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.713 -1.137 . . . . 36.590000000000003 110.074 175.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -44.53 140.2 2.47 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.744 1.611 . . . . 73.760000000000005 111.355 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.88 1.37 39.22 Favored Glycine 0 CA--C 1.553 2.436 0 N-CA-C 118.164 2.026 . . . . 48.909999999999997 118.164 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' ASP . 3.1 mt-30 -84.99 126.34 68.16 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 119.598 -2.119 . . . . 60.020000000000003 114.758 177.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.81 157.16 52.19 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.81 2.34 . . . . 45.479999999999997 110.042 166.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 13' ' ' PHE . . . -53.76 146.33 13.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.395 -1.275 . . . . 33.420000000000002 112.254 170.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -70.31 130.63 42.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 O-C-N 120.386 -1.446 . . . . 28.93 109.502 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.27 156.76 74.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 O-C-N 119.946 -1.721 . . . . 32.060000000000002 112.707 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -51.72 140.53 46.5 Favored 'Trans proline' 0 C--N 1.356 0.963 0 CA-C-O 125.669 2.279 . . . . 34.890000000000001 112.242 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 153.99 -179.03 30.55 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 126.265 3.147 . . . . 25.550000000000001 111.402 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 70.7 mt -93.77 126.12 38.77 Favored 'General case' 0 C--O 1.249 1.063 1 CA-C-N 107.084 -4.558 . . . . 26.850000000000001 114.655 171.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -126.66 156.41 41.06 Favored 'General case' 0 N--CA 1.444 -0.765 1 CA-C-N 107.867 -4.242 . . . . 31.780000000000001 114.559 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.7 t -127.46 166.95 16.96 Favored 'General case' 0 C--N 1.315 -0.93 0 O-C-N 119.922 -1.737 . . . . 35.329999999999998 110.209 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.2 t -82.76 135.11 25.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 118.602 -2.561 . . . . 34.659999999999997 114.862 -175.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -84.56 144.09 28.88 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.752 -1.843 . . . . 31.41 109.508 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mt -53.98 -34.32 59.47 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 115.389 1.626 . . . . 32.0 115.389 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 93.5 p -59.4 -5.72 0.85 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 117.048 2.24 . . . . 32.990000000000002 117.048 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 m -72.25 -20.92 61.46 Favored 'General case' 0 CA--C 1.494 -1.176 0 O-C-N 119.797 -1.814 . . . . 21.920000000000002 113.716 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -100.22 151.6 21.25 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 117.681 2.474 . . . . 24.449999999999999 117.681 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.54 ' HZ3' ' HA ' ' A' ' 79' ' ' ASP . 17.8 pttm -155.23 163.16 40.55 Favored 'General case' 0 C--N 1.292 -1.91 0 O-C-N 117.808 -3.058 . . . . 64.319999999999993 108.962 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 37.6 t -89.85 132.41 34.61 Favored 'Isoleucine or valine' 0 C--N 1.361 1.09 0 N-CA-C 106.933 -1.506 . . . . 24.210000000000001 106.933 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.46 179.71 47.9 Favored Glycine 0 C--N 1.301 -1.41 0 O-C-N 119.628 -1.92 . . . . 24.350000000000001 113.049 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -70.48 -0.61 8.75 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 117.226 2.306 . . . . 46.32 117.226 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -111.93 16.34 20.37 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 122.902 2.592 . . . . 33.399999999999999 108.392 173.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.17 -4.5 62.36 Favored Glycine 0 N--CA 1.471 1.02 0 N-CA-C 118.96 2.344 . . . . 20.449999999999999 118.96 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 p -92.22 162.12 14.44 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 118.996 -2.473 . . . . 34.789999999999999 114.092 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.0 tp -73.73 131.22 41.37 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 119.83 -1.794 . . . . 20.079999999999998 109.065 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' MET . . . . . 0.458 ' SD ' ' HE2' ' A' ' 69' ' ' LYS . 18.8 ptm -126.69 168.58 14.17 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 121.024 -1.047 . . . . 46.630000000000003 113.745 171.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.52 132.09 36.02 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 O-C-N 116.814 -3.678 . . . . 21.68 109.128 171.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.54 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 21.4 t0 -81.36 -69.17 0.63 Allowed 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 113.066 -1.879 . . . . 34.229999999999997 110.141 175.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -143.66 131.71 21.74 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 102.794 -3.039 . . . . 48.140000000000001 102.794 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 tp -66.36 113.28 4.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 121.431 1.923 . . . . 29.399999999999999 111.282 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 70.9 mtt85 -117.4 130.14 56.3 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 126.143 1.777 . . . . 27.609999999999999 106.56 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 38.6 mt -119.85 151.66 38.52 Favored 'General case' 0 CA--C 1.484 -1.584 0 N-CA-C 115.371 1.619 . . . . 24.280000000000001 115.371 -165.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 12.9 m -132.37 145.49 57.52 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-O 117.749 -1.12 . . . . 27.489999999999998 112.243 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -48.7 131.01 23.69 Favored 'Trans proline' 0 N--CA 1.442 -1.532 0 C-N-CA 123.769 2.979 . . . . 37.390000000000001 114.061 174.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 116.973 2.212 . . . . 52.25 116.973 179.445 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.466 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_