data_6iw3_residue ############################ # Computer software used # ############################ 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 6iw3 _Structure_validation_residue.Date_analyzed 2019-02-15 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 ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.18 0 CA-C-O 120.906 0.17 . . . . 55.78 112.805 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -142.16 138.94 31.94 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 56.29 111.356 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.0 m -118.68 133.54 55.78 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.333 -0.618 . . . . 30.83 109.333 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -92.68 130.2 38.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.094 -0.706 . . . . 71.03 109.094 172.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.0 t -117.32 119.13 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 107.776 -1.194 . . . . 23.76 107.776 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -102.13 122.48 54.44 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 104.79 -2.3 . . . . 46.13 104.79 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -132.43 148.78 52.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.638 -1.225 . . . . 30.99 112.572 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -110.22 140.53 44.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.92 -1.141 . . . . 34.8 107.92 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -108.36 113.41 26.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.262 -1.014 . . . . 54.18 108.262 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 46.07 -126.28 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.573 0.545 . . . . 55.48 111.857 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -94.02 5.24 52.34 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 115.158 1.54 . . . . 77.57 115.158 -176.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.36 126.71 28.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.545 0.212 . . . . 51.66 111.017 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.43 -39.57 81.5 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.855 0.687 . . . . 84.95 112.855 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.6 m -83.34 118.78 72.58 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 112.143 0.423 . . . . 38.5 112.143 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -75.98 161.27 36.09 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 N-CA-C 114.176 0.799 . . . . 40.55 114.176 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -106.52 149.7 26.85 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 114.63 -1.168 . . . . 39.35 108.463 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.0 tt -129.74 124.7 34.13 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.655 -0.498 . . . . 27.62 109.655 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.46 145.89 33.22 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.811 -0.631 . . . . 23.85 109.658 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -109.49 124.08 50.47 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.591 -1.263 . . . . 71.18 107.591 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -108.44 126.51 29.42 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-N 115.445 -0.798 . . . . 35.47 110.822 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.39 51.58 2.96 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 121.435 1.423 . . . . 42.8 113.608 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.6 t -132.66 138.75 32.74 Favored Pre-proline 0 N--CA 1.451 -0.384 0 N-CA-C 105.566 -2.013 . . . . 46.46 105.566 171.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -68.73 148.91 72.59 Favored 'Trans proline' 0 CA--C 1.517 -0.373 0 C-N-CA 118.221 -0.719 . . . . 49.08 110.315 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.4 -27.32 69.01 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.124 0.786 . . . . 34.54 113.124 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.65 -34.26 76.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.843 -0.617 . . . . 70.46 111.158 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.0 mtm180 -100.51 -6.12 25.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 119.243 3.053 . . . . 75.16 119.243 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.89 138.6 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 119.913 -0.715 . . . . 34.16 111.137 -166.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.1 p -121.86 164.25 17.84 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.744 -0.662 . . . . 35.41 110.736 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.7 tp -56.31 -40.32 74.18 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.53 -0.468 . . . . 26.8 110.397 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.04 -35.05 82.04 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.633 -0.794 . . . . 30.22 113.474 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -65.08 -40.67 94.98 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.56 -0.533 . . . . 40.1 109.56 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -49.16 64.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.666 -0.697 . . . . 25.24 110.298 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -60.32 -27.12 67.08 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.357 0.503 . . . . 41.52 112.357 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.2 p -68.87 -22.66 64.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.345 -0.389 . . . . 39.04 111.524 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.7 m -97.28 -1.27 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 113.856 1.058 . . . . 47.84 113.856 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 79.4 mt -92.23 143.35 26.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.937 -0.764 . . . . 54.74 108.937 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -68.06 -41.05 82.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.227 0.454 . . . . 70.86 112.227 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.5 mtt85 -132.14 76.72 72.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 86.71 110.282 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' OH ' ' A' ' 55' ' ' TYR . 69.3 Cg_endo -70.03 -17.31 36.43 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 123.014 2.476 . . . . 59.43 113.473 -176.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.53 150.1 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 114.409 1.263 . . . . 61.89 114.409 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.77 -24.2 9.2 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.423 -0.808 . . . . 69.13 112.414 165.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.86 154.52 27.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.389 -0.406 . . . . 52.34 110.919 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -101.45 146.46 27.6 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.178 -1.415 . . . . 70.68 107.178 166.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . 0.463 ' OH ' ' O ' ' A' ' 50' ' ' PRO . 82.5 m-85 -118.48 127.57 53.77 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.089 -0.505 . . . . 38.23 110.241 -175.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -119.8 145.51 46.54 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 123.657 0.598 . . . . 36.3 109.58 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -131.33 139.89 49.62 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 112.504 0.557 . . . . 22.74 112.504 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -62.84 125.46 24.04 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.62 -0.882 . . . . 43.04 108.62 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -149.58 -172.91 4.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.286 -0.87 . . . . 42.55 109.036 -169.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.1 mmm -129.33 140.42 51.39 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.655 -0.248 . . . . 83.26 110.432 -177.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -119.2 146.58 45.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.911 -1.144 . . . . 54.13 107.911 171.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.09 -49.58 75.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.117 0.414 . . . . 86.63 112.117 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -82.83 -39.82 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 115.757 1.762 . . . . 86.0 115.757 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -92.29 -10.13 39.53 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.81 2.152 . . . . 54.28 116.81 -171.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 70.53 -131.41 21.78 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 111.43 -0.668 . . . . 43.52 111.43 -174.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.57 126.75 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 119.691 -0.804 . . . . 36.36 111.218 -176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 28.6 m -135.42 166.82 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.038 0.447 . . . . 33.01 110.701 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -105.27 108.52 20.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.325 -0.991 . . . . 33.78 108.325 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -100.24 127.52 46.5 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 115.848 -0.614 . . . . 56.58 111.021 -168.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -76.89 135.38 38.81 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.209 -0.996 . . . . 55.14 109.363 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 55.1 mt -131.84 116.39 30.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 105.859 -1.904 . . . . 30.67 105.859 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 86.7 p -104.2 -7.92 19.76 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 120.307 3.447 . . . . 40.81 120.307 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -97.76 119.58 36.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.723 -0.843 . . . . 41.88 108.723 -173.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -54.19 -30.12 48.44 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.022 1.119 . . . . 38.98 114.022 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -83.24 -2.72 56.29 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 114.645 1.35 . . . . 47.18 114.645 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -80.47 138.5 36.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 30.95 112.384 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -73.44 145.76 45.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.36 -0.536 . . . . 73.4 110.02 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.52 138.56 22.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.578 -0.737 . . . . 25.62 111.321 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.78 144.58 59.91 Favored 'Trans proline' 0 CA--C 1.511 -0.663 0 O-C-N 122.402 0.685 . . . . 25.38 111.19 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.2 p -149.34 163.24 38.27 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 115.556 -0.747 . . . . 26.62 110.406 -176.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -137.63 123.58 20.18 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.431 -1.322 . . . . 35.5 107.431 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 48.5 43.32 19.86 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 123.987 0.805 . . . . 31.32 112.696 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.3 9.5 86.48 Favored Glycine 0 C--O 1.243 0.681 0 CA-C-N 114.858 -1.065 . . . . 26.0 113.843 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -118.42 132.9 56.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.582 0.706 . . . . 52.83 111.009 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.27 139.31 32.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 N-CA-C 106.884 -1.525 . . . . 21.11 106.884 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.1 t -119.23 128.04 75.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.984 -1.117 . . . . 25.98 107.984 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.8 t -134.52 152.05 51.53 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 120.628 -0.429 . . . . 22.05 110.682 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.9 m-90 -122.88 129.88 52.17 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.288 -1.375 . . . . 32.41 107.288 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.01 135.86 43.9 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.609 -0.885 . . . . 36.77 108.609 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.6 114.99 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 123.614 0.571 . . . . 42.71 109.667 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.2 p -77.05 154.6 33.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.778 0.323 . . . . 57.05 111.222 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.41 111.093 179.838 . . . . . . . . 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 ' 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 0 . 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 orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.18 0 CA-C-O 120.906 0.17 . . . . 55.78 112.805 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -142.16 138.94 31.94 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 56.29 111.356 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.0 m -118.68 133.54 55.78 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.333 -0.618 . . . . 30.83 109.333 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -92.68 130.2 38.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.094 -0.706 . . . . 71.03 109.094 172.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.0 t -117.32 119.13 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 107.776 -1.194 . . . . 23.76 107.776 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -102.13 122.48 54.44 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 104.79 -2.3 . . . . 46.13 104.79 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -132.43 148.78 52.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.638 -1.225 . . . . 30.99 112.572 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -110.22 140.53 44.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.92 -1.141 . . . . 34.8 107.92 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -108.36 113.41 26.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.262 -1.014 . . . . 54.18 108.262 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 46.07 -126.28 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.573 0.545 . . . . 55.48 111.857 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -94.02 5.24 52.34 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 115.158 1.54 . . . . 77.57 115.158 -176.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.36 126.71 28.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.545 0.212 . . . . 51.66 111.017 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.43 -39.57 81.5 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.855 0.687 . . . . 84.95 112.855 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.6 m -83.34 118.78 72.58 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 112.143 0.423 . . . . 38.5 112.143 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -75.98 161.27 36.09 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 N-CA-C 114.176 0.799 . . . . 40.55 114.176 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -106.52 149.7 26.85 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 114.63 -1.168 . . . . 39.35 108.463 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.0 tt -129.74 124.7 34.13 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.655 -0.498 . . . . 29.3 109.655 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.46 145.89 33.22 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.811 -0.631 . . . . 24.01 109.658 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -109.49 124.08 50.47 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.591 -1.263 . . . . 71.18 107.591 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -108.44 126.51 29.42 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-N 115.445 -0.798 . . . . 35.47 110.822 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.39 51.58 2.96 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 121.435 1.423 . . . . 42.8 113.608 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.6 t -132.66 138.75 32.74 Favored Pre-proline 0 N--CA 1.451 -0.384 0 N-CA-C 105.566 -2.013 . . . . 46.46 105.566 171.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HB2' ' OE1' ' A' ' 36' ' ' GLU . 35.2 Cg_endo -68.73 148.91 72.59 Favored 'Trans proline' 0 CA--C 1.517 -0.373 0 C-N-CA 118.221 -0.719 . . . . 49.08 110.315 -179.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.4 -27.32 69.01 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.124 0.786 . . . . 34.54 113.124 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 4.0 mp0 -62.65 -34.26 76.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.843 -0.617 . . . . 70.46 111.158 178.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.0 mtm180 -100.51 -6.12 25.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 119.243 3.053 . . . . 75.16 119.243 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.89 138.6 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 119.913 -0.715 . . . . 34.16 111.137 -166.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.1 p -121.86 164.25 17.84 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.744 -0.662 . . . . 35.41 110.736 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.7 tp -56.31 -40.32 74.18 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.53 -0.468 . . . . 26.8 110.397 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.04 -35.05 82.04 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.633 -0.794 . . . . 30.22 113.474 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -65.08 -40.67 94.98 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.56 -0.533 . . . . 40.1 109.56 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -49.16 64.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.666 -0.697 . . . . 25.24 110.298 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -60.32 -27.12 67.08 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.357 0.503 . . . . 41.52 112.357 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.2 p -68.87 -22.66 64.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.345 -0.389 . . . . 42.58 111.524 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.7 m -97.28 -1.27 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 113.856 1.058 . . . . 47.84 113.856 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 79.4 mt -92.23 143.35 26.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.937 -0.764 . . . . 54.74 108.937 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -68.06 -41.05 82.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.227 0.454 . . . . 70.86 112.227 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.5 mtt85 -132.14 76.72 72.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 86.71 110.282 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -70.03 -17.31 36.43 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 123.014 2.476 . . . . 59.43 113.473 -176.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.53 150.1 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 114.409 1.263 . . . . 61.89 114.409 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.77 -24.2 9.2 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.423 -0.808 . . . . 69.13 112.414 165.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.86 154.52 27.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.389 -0.406 . . . . 52.34 110.919 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -101.45 146.46 27.6 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.178 -1.415 . . . . 70.68 107.178 166.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -118.48 127.57 53.77 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.089 -0.505 . . . . 38.23 110.241 -175.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -119.8 145.51 46.54 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 123.657 0.598 . . . . 36.3 109.58 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -131.33 139.89 49.62 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 112.504 0.557 . . . . 22.74 112.504 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -62.84 125.46 24.04 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.62 -0.882 . . . . 43.04 108.62 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -149.58 -172.91 4.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.286 -0.87 . . . . 42.55 109.036 -169.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.1 mmm -129.33 140.42 51.39 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.655 -0.248 . . . . 83.26 110.432 -177.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -119.2 146.58 45.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.911 -1.144 . . . . 54.13 107.911 171.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.09 -49.58 75.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.117 0.414 . . . . 86.63 112.117 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -82.83 -39.82 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 115.757 1.762 . . . . 86.0 115.757 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -92.29 -10.13 39.53 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.81 2.152 . . . . 54.28 116.81 -171.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 70.53 -131.41 21.78 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 111.43 -0.668 . . . . 43.52 111.43 -174.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.57 126.75 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 119.691 -0.804 . . . . 36.36 111.218 -176.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 28.6 m -135.42 166.82 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.038 0.447 . . . . 33.01 110.701 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -105.27 108.52 20.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.325 -0.991 . . . . 33.78 108.325 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -100.24 127.52 46.5 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 115.848 -0.614 . . . . 56.58 111.021 -168.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -76.89 135.38 38.81 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.209 -0.996 . . . . 55.14 109.363 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 55.1 mt -131.84 116.39 30.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 105.859 -1.904 . . . . 30.67 105.859 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 86.7 p -104.2 -7.92 19.76 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 120.307 3.447 . . . . 40.81 120.307 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -97.76 119.58 36.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.723 -0.843 . . . . 41.88 108.723 -173.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -54.19 -30.12 48.44 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.022 1.119 . . . . 38.98 114.022 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -83.24 -2.72 56.29 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 114.645 1.35 . . . . 47.18 114.645 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -80.47 138.5 36.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 30.95 112.384 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 124' ' ' HOH . 4.4 mtt180 -73.44 145.76 45.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.36 -0.536 . . . . 73.4 110.02 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.52 138.56 22.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.578 -0.737 . . . . 25.62 111.321 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.78 144.58 59.91 Favored 'Trans proline' 0 CA--C 1.511 -0.663 0 O-C-N 122.402 0.685 . . . . 25.38 111.19 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.2 p -149.34 163.24 38.27 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 115.556 -0.747 . . . . 26.62 110.406 -176.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -137.63 123.58 20.18 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.431 -1.322 . . . . 35.5 107.431 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 48.5 43.32 19.86 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 123.987 0.805 . . . . 31.32 112.696 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.3 9.5 86.48 Favored Glycine 0 C--O 1.243 0.681 0 CA-C-N 114.858 -1.065 . . . . 26.0 113.843 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -118.42 132.9 56.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.582 0.706 . . . . 52.83 111.009 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.27 139.31 32.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 N-CA-C 106.884 -1.525 . . . . 21.11 106.884 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.1 t -119.23 128.04 75.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.984 -1.117 . . . . 25.98 107.984 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.8 t -134.52 152.05 51.53 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 120.628 -0.429 . . . . 22.05 110.682 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.9 m-90 -122.88 129.88 52.17 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.288 -1.375 . . . . 32.41 107.288 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.01 135.86 43.9 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.609 -0.885 . . . . 36.77 108.609 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.6 114.99 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 123.614 0.571 . . . . 42.71 109.667 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.2 p -77.05 154.6 33.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.778 0.323 . . . . 57.05 111.222 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.41 111.093 179.838 . . . . . . . . 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 ' 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 . . . . . 0.413 ' O ' ' HD3' ' A' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.18 0 CA-C-O 120.906 0.17 . . . . 55.78 112.805 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -142.16 138.94 31.94 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.994 -0.282 . . . . 56.29 111.356 -178.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 85.0 m -118.68 133.54 55.78 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.333 -0.618 . . . . 30.83 109.333 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -92.68 130.2 38.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.094 -0.706 . . . . 71.03 109.094 172.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.0 t -117.32 119.13 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 107.776 -1.194 . . . . 23.76 107.776 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -102.13 122.48 54.44 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 104.79 -2.3 . . . . 46.13 104.79 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -132.43 148.78 52.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.638 -1.225 . . . . 30.99 112.572 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -110.22 140.53 44.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.92 -1.141 . . . . 34.8 107.92 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -108.36 113.41 26.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.262 -1.014 . . . . 54.18 108.262 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 46.07 -126.28 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.573 0.545 . . . . 55.48 111.857 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -94.02 5.24 52.34 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 115.158 1.54 . . . . 77.57 115.158 -176.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.36 126.71 28.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.545 0.212 . . . . 51.66 111.017 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.43 -39.57 81.5 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.855 0.687 . . . . 84.95 112.855 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.6 m -83.34 118.78 72.58 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 112.143 0.423 . . . . 38.5 112.143 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -75.98 161.27 36.09 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 N-CA-C 114.176 0.799 . . . . 40.55 114.176 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -106.52 149.7 26.85 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 114.63 -1.168 . . . . 39.35 108.463 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.0 tt -129.74 124.7 34.13 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.655 -0.498 . . . . 29.3 109.655 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.2 m -126.46 145.89 33.22 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.811 -0.631 . . . . 24.01 109.658 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -109.49 124.08 50.47 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.591 -1.263 . . . . 71.18 107.591 175.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -108.44 126.51 29.42 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-N 115.445 -0.798 . . . . 35.47 110.822 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.39 51.58 2.96 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 121.435 1.423 . . . . 42.8 113.608 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.6 t -132.66 138.75 32.74 Favored Pre-proline 0 N--CA 1.451 -0.384 0 N-CA-C 105.566 -2.013 . . . . 46.46 105.566 171.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HB2' ' OE1' ' A' ' 36' ' ' GLU . 35.2 Cg_endo -68.73 148.91 72.59 Favored 'Trans proline' 0 CA--C 1.517 -0.373 0 C-N-CA 118.221 -0.719 . . . . 49.08 110.315 -179.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.4 -27.32 69.01 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 113.124 0.786 . . . . 34.54 113.124 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 4.0 mp0 -62.65 -34.26 76.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.843 -0.617 . . . . 70.46 111.158 178.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.0 mtm180 -100.51 -6.12 25.94 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 119.243 3.053 . . . . 75.16 119.243 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.89 138.6 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 119.913 -0.715 . . . . 34.16 111.137 -166.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.1 p -121.86 164.25 17.84 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.744 -0.662 . . . . 35.41 110.736 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.7 tp -56.31 -40.32 74.18 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.53 -0.468 . . . . 26.8 110.397 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.04 -35.05 82.04 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.633 -0.794 . . . . 30.22 113.474 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -65.08 -40.67 94.98 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.56 -0.533 . . . . 40.1 109.56 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -49.16 64.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.666 -0.697 . . . . 25.24 110.298 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -60.32 -27.12 67.08 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.357 0.503 . . . . 41.52 112.357 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.2 p -68.87 -22.66 64.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.345 -0.389 . . . . 42.58 111.524 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.7 m -97.28 -1.27 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 113.856 1.058 . . . . 47.84 113.856 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 79.4 mt -92.23 143.35 26.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.937 -0.764 . . . . 54.74 108.937 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -68.06 -41.05 82.59 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.227 0.454 . . . . 70.86 112.227 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.5 mtt85 -132.14 76.72 72.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 86.71 110.282 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -70.03 -17.31 36.43 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 123.014 2.476 . . . . 59.43 113.473 -176.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.53 150.1 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 114.409 1.263 . . . . 61.89 114.409 -172.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.77 -24.2 9.2 Favored Glycine 0 C--N 1.331 0.273 0 CA-C-N 115.423 -0.808 . . . . 69.13 112.414 165.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.86 154.52 27.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.389 -0.406 . . . . 52.34 110.919 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -101.45 146.46 27.6 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.178 -1.415 . . . . 70.68 107.178 166.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -118.48 127.57 53.77 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.089 -0.505 . . . . 38.23 110.241 -175.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -119.8 145.51 46.54 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 123.657 0.598 . . . . 36.3 109.58 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -131.33 139.89 49.62 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 112.504 0.557 . . . . 22.74 112.504 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -62.84 125.46 24.04 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.62 -0.882 . . . . 43.04 108.62 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -149.58 -172.91 4.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.286 -0.87 . . . . 42.55 109.036 -169.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.1 mmm -129.33 140.42 51.39 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.655 -0.248 . . . . 83.26 110.432 -177.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -119.2 146.58 45.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.911 -1.144 . . . . 54.13 107.911 171.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.09 -49.58 75.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.117 0.414 . . . . 86.63 112.117 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -82.83 -39.82 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 115.757 1.762 . . . . 86.0 115.757 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -92.29 -10.13 39.53 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 116.81 2.152 . . . . 54.28 116.81 -171.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 70.53 -131.41 21.78 Favored Glycine 0 CA--C 1.519 0.286 0 N-CA-C 111.43 -0.668 . . . . 43.52 111.43 -174.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.57 126.75 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 119.691 -0.804 . . . . 36.36 111.218 -176.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 28.6 m -135.42 166.82 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.038 0.447 . . . . 33.01 110.701 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -105.27 108.52 20.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.325 -0.991 . . . . 33.78 108.325 173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -100.24 127.52 46.5 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 115.848 -0.614 . . . . 56.58 111.021 -168.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -76.89 135.38 38.81 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.209 -0.996 . . . . 55.14 109.363 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 55.1 mt -131.84 116.39 30.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 105.859 -1.904 . . . . 30.67 105.859 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 86.7 p -104.2 -7.92 19.76 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 120.307 3.447 . . . . 40.81 120.307 176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -97.76 119.58 36.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.723 -0.843 . . . . 41.88 108.723 -173.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -54.19 -30.12 48.44 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.022 1.119 . . . . 38.98 114.022 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -83.24 -2.72 56.29 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 114.645 1.35 . . . . 47.18 114.645 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -80.47 138.5 36.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 30.95 112.384 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 124' ' ' HOH . 4.4 mtt180 -73.44 145.76 45.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.36 -0.536 . . . . 73.4 110.02 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.52 138.56 22.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.578 -0.737 . . . . 25.62 111.321 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.78 144.58 59.91 Favored 'Trans proline' 0 CA--C 1.511 -0.663 0 O-C-N 122.402 0.685 . . . . 25.38 111.19 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.2 p -149.34 163.24 38.27 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 115.556 -0.747 . . . . 26.62 110.406 -176.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -137.63 123.58 20.18 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.431 -1.322 . . . . 35.5 107.431 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 48.5 43.32 19.86 Favored 'General case' 0 C--O 1.227 -0.104 0 O-C-N 123.987 0.805 . . . . 31.32 112.696 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.3 9.5 86.48 Favored Glycine 0 C--O 1.243 0.681 0 CA-C-N 114.858 -1.065 . . . . 26.0 113.843 173.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -118.42 132.9 56.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.582 0.706 . . . . 52.83 111.009 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.27 139.31 32.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 N-CA-C 106.884 -1.525 . . . . 21.11 106.884 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.1 t -119.23 128.04 75.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.984 -1.117 . . . . 25.98 107.984 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.8 t -134.52 152.05 51.53 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 120.628 -0.429 . . . . 22.05 110.682 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.9 m-90 -122.88 129.88 52.17 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.288 -1.375 . . . . 32.41 107.288 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.01 135.86 43.9 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.609 -0.885 . . . . 36.77 108.609 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.6 114.99 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 123.614 0.571 . . . . 42.71 109.667 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.2 p -77.05 154.6 33.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.778 0.323 . . . . 57.05 111.222 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.41 111.093 179.838 . . . . . . . . 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 ' 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 . . . . . 0.413 ' O ' ' HD3' ' A' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_