data_6vz6_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 6vz6 _Structure_validation_residue.Date_analyzed 2020-03-06 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 ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.532 -0.544 . . . . 73.87 109.532 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp -81.95 -50.0 9.65 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-O 119.018 -0.515 . . . . 77.23 110.946 -165.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -112.6 152.32 29.05 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 115.944 1.831 . . . . 81.04 115.944 -161.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -99.97 132.45 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.392 1.077 . . . . 75.48 111.479 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -120.51 134.74 55.24 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.037 -1.097 . . . . 29.21 108.037 -172.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.1 p -82.21 171.6 14.1 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.242 -0.983 . . . . 29.01 109.622 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.4 m -55.37 -48.7 73.87 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-N 115.707 -0.679 . . . . 28.85 111.339 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.84 -42.32 98.9 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.641 -0.254 . . . . 78.04 111.571 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -63.76 -46.85 83.44 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.549 0.69 . . . . 37.44 111.129 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.02 -35.41 71.22 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.282 -0.567 . . . . 21.41 110.781 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.48 -20.8 61.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.594 0.591 . . . . 22.76 112.594 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.19 -30.51 69.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.675 -0.81 . . . . 64.62 112.282 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -94.92 68.29 3.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 122.737 1.256 . . . . 27.29 109.316 -169.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -107.15 16.86 23.65 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 114.138 -1.392 . . . . 36.17 112.186 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.14 7.43 87.68 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.764 -1.684 . . . . 23.11 115.682 173.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -123.07 152.88 40.59 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 118.467 1.133 . . . . 61.2 111.405 -176.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 66.56 35.6 5.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.492 -0.776 . . . . 60.15 111.642 167.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.1 -0.9 87.69 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.469 -1.348 . . . . 23.29 115.037 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -92.14 143.52 26.35 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.762 1.281 . . . . 38.12 111.329 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -65.78 164.87 13.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.408 0.623 . . . . 28.37 110.543 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.6 t -105.8 102.59 12.02 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.608 -0.724 . . . . 23.82 109.468 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -108.76 154.13 22.5 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.451 1.101 . . . . 21.17 109.279 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -145.13 167.81 21.84 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.991 -0.744 . . . . 20.9 108.991 163.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' O ' ' A' ' 27' ' ' LYS . . . -109.36 146.31 34.6 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.986 0.898 . . . . 18.08 110.011 175.34 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -147.43 115.33 6.47 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.543 -1.28 . . . . 26.77 107.543 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 48.57 51.67 15.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 122.011 0.91 . . . . 52.38 111.211 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.56 -14.32 41.92 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 116.202 1.241 . . . . 20.01 116.202 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' A' ' 23' ' ' ALA . 23.6 mtmm -97.81 138.88 34.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.651 1.225 . . . . 35.59 109.958 -176.42 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.5 t -101.05 118.28 47.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 107.887 -1.153 . . . . 20.65 107.887 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -101.63 146.8 27.21 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.824 0.85 . . . . 19.47 109.637 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -105.22 109.33 21.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.746 -0.835 . . . . 23.79 108.746 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.2 m -112.38 19.6 6.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 C-N-CA 120.86 -0.336 . . . . 20.81 111.234 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.1 m -50.57 -33.21 21.04 Favored 'General case' 0 C--O 1.241 0.609 0 O-C-N 122.161 -0.337 . . . . 27.33 111.708 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -80.95 -15.49 56.12 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 125.286 1.434 . . . . 70.22 113.752 -175.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -70.34 132.96 46.45 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-N 119.099 0.863 . . . . 31.03 110.594 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 2.8 mtm -65.49 -16.45 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 124.89 112.426 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -94.66 3.16 55.41 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.826 1.047 . . . . 45.97 113.826 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -121.96 32.19 5.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.272 0.487 . . . . 23.47 110.984 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -64.35 135.3 56.03 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.356 0.598 . . . . 77.62 109.621 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.0 t0 56.48 21.59 5.75 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.353 -0.84 . . . . 57.2 111.823 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.09 17.78 79.58 Favored Glycine 0 C--N 1.335 0.485 0 CA-C-O 119.544 -0.587 . . . . 29.25 113.899 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -114.65 127.96 56.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.478 -1.305 . . . . 34.88 107.478 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -114.79 106.53 14.31 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.805 -0.813 . . . . 24.14 108.805 -176.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . 0.407 ' HG3' ' CHB' ' A' ' 101' ' ' HEM . 72.0 mm-40 57.63 28.21 15.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.216 0.821 . . . . 42.51 113.216 172.551 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.37 5.54 55.15 Favored Glycine 0 CA--C 1.501 -0.797 0 CA-C-O 119.358 -0.69 . . . . 25.43 114.767 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.6 mtp -125.27 -23.02 4.24 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 114.45 1.278 . . . . 35.88 114.45 -173.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . 1.089 ' NE2' ' CAB' ' A' ' 101' ' ' HEM . 37.4 m-70 -130.05 149.36 51.8 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 119.569 1.077 . . . . 26.58 111.131 -176.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -128.83 150.41 50.33 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.657 -1.156 . . . . 90.2 110.713 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.27 174.94 33.41 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.829 -1.308 . . . . 25.38 109.829 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.72 9.01 75.63 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 116.067 1.187 . . . . 22.84 116.067 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.9 mm -136.21 155.27 34.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 124.252 1.021 . . . . 52.67 109.041 -167.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -77.44 108.49 10.64 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.91 -1.144 . . . . 19.58 107.91 168.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 82.6 mt -97.95 20.47 12.16 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 112.571 0.582 . . . . 19.64 112.571 -174.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.0 m -57.99 -50.52 73.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.872 -0.731 . . . . 21.45 110.887 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.82 98.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.401 -0.812 . . . . 21.59 110.638 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.87 -26.48 66.05 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 121.443 -0.786 . . . . 41.41 111.502 -173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -63.71 -21.14 66.24 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 119.11 -1.036 . . . . 31.74 111.83 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -61.35 -30.33 70.45 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 119.486 -0.885 . . . . 52.53 110.222 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -95.94 -4.02 44.14 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.137 0.792 . . . . 46.69 113.137 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.93 148.79 94.49 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 120.022 -0.671 . . . . 25.87 109.676 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.19 31.88 0.52 Allowed 'Trans proline' 0 C--N 1.326 -0.632 0 C-N-CA 120.059 0.506 . . . . 31.84 113.033 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -150.01 159.69 44.2 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.055 -1.091 . . . . 26.33 108.055 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -78.67 170.5 16.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.386 -0.825 . . . . 52.26 109.259 166.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -79.03 4.04 15.59 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 112.219 0.452 . . . . 24.71 112.219 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -61.31 -22.87 65.28 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.135 0.42 . . . . 60.98 112.135 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 m -66.39 -17.74 22.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 119.961 -0.696 . . . . 30.7 112.189 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.6 mt -76.04 -21.64 56.58 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.802 0.667 . . . . 31.17 112.802 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -65.03 -24.32 67.45 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 112.878 0.696 . . . . 46.22 112.878 -166.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -78.51 -0.72 30.63 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.968 1.099 . . . . 49.42 113.968 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -116.52 144.71 33.71 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 120.152 1.342 . . . . 29.7 110.558 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.87 140.89 26.38 Favored 'Trans proline' 0 C--O 1.242 0.719 0 CA-C-O 122.633 1.014 . . . . 21.5 112.406 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 65.2 t -86.9 119.7 35.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.028 -1.442 . . . . 19.33 107.616 168.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.8 m -109.21 -1.15 9.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.093 0.957 . . . . 23.6 112.491 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 174.42 -161.77 31.79 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.135 -1.031 . . . . 25.64 112.72 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 52.6 m -134.53 138.38 44.6 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.502 -1.349 . . . . 37.31 108.59 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 53.5 tp -87.39 113.44 23.11 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 107.304 -1.369 . . . . 24.37 107.304 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.492 -1.264 0 C-N-CA 130.112 3.365 . . . . 61.07 115.25 -169.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HEM . . . . . 1.089 ' CAB' ' NE2' ' A' ' 46' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.532 -0.544 . . . . 61.65 109.532 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp -81.95 -50.0 9.65 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-O 119.018 -0.515 . . . . 71.08 110.946 -165.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -112.6 152.32 29.05 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 115.944 1.831 . . . . 81.04 115.944 -161.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -99.97 132.45 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.392 1.077 . . . . 75.48 111.479 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -120.51 134.74 55.24 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.037 -1.097 . . . . 24.32 108.037 -172.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.1 p -82.21 171.6 14.1 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.242 -0.983 . . . . 24.15 109.622 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.4 m -55.37 -48.7 73.87 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-N 115.707 -0.679 . . . . 24.03 111.339 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.84 -42.32 98.9 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.641 -0.254 . . . . 78.04 111.571 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -63.76 -46.85 83.44 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.549 0.69 . . . . 37.44 111.129 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.02 -35.41 71.22 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.282 -0.567 . . . . 17.82 110.781 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.48 -20.8 61.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.594 0.591 . . . . 18.94 112.594 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.19 -30.51 69.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.675 -0.81 . . . . 53.83 112.282 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -94.92 68.29 3.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 122.737 1.256 . . . . 25.37 109.316 -169.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -107.15 16.86 23.65 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 114.138 -1.392 . . . . 30.93 112.186 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.14 7.43 87.68 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.764 -1.684 . . . . 23.11 115.682 173.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -123.07 152.88 40.59 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 118.467 1.133 . . . . 50.98 111.405 -176.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 66.56 35.6 5.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.492 -0.776 . . . . 55.47 111.642 167.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.1 -0.9 87.69 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.469 -1.348 . . . . 19.69 115.037 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -92.14 143.52 26.35 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.762 1.281 . . . . 35.34 111.329 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -65.78 164.87 13.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.408 0.623 . . . . 23.62 110.543 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.6 t -105.8 102.59 12.02 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.608 -0.724 . . . . 19.83 109.468 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -108.76 154.13 22.5 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.451 1.101 . . . . 17.62 109.279 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -145.13 167.81 21.84 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.991 -0.744 . . . . 17.39 108.991 163.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HB3' ' HA ' ' A' ' 51' ' ' ASP . . . -109.36 146.31 34.6 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.986 0.898 . . . . 15.05 110.011 175.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -147.43 115.33 6.47 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.543 -1.28 . . . . 22.29 107.543 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 48.57 51.67 15.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 122.011 0.91 . . . . 43.63 111.211 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.56 -14.32 41.92 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 116.202 1.241 . . . . 18.12 116.202 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmm -97.81 138.88 34.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.651 1.225 . . . . 29.64 109.958 -176.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.5 t -101.05 118.28 47.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 107.887 -1.153 . . . . 17.19 107.887 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -101.63 146.8 27.21 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.824 0.85 . . . . 16.2 109.637 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -105.22 109.33 21.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.746 -0.835 . . . . 22.45 108.746 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.2 m -112.38 19.6 6.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 C-N-CA 120.86 -0.336 . . . . 17.32 111.234 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.1 m -50.57 -33.21 21.04 Favored 'General case' 0 C--O 1.241 0.609 0 O-C-N 122.161 -0.337 . . . . 22.76 111.708 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -80.95 -15.49 56.12 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 125.286 1.434 . . . . 70.22 113.752 -175.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -70.34 132.96 46.45 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-N 119.099 0.863 . . . . 25.84 110.594 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 2.8 mtm -65.49 -16.45 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 124.89 112.426 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -94.66 3.16 55.41 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.826 1.047 . . . . 38.29 113.826 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -121.96 32.19 5.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.272 0.487 . . . . 22.84 110.984 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -64.35 135.3 56.03 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.356 0.598 . . . . 74.28 109.621 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.0 t0 56.48 21.59 5.75 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.353 -0.84 . . . . 57.2 111.823 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.09 17.78 79.58 Favored Glycine 0 C--N 1.335 0.485 0 CA-C-O 119.544 -0.587 . . . . 24.36 113.899 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -114.65 127.96 56.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.478 -1.305 . . . . 33.38 107.478 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -114.79 106.53 14.31 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.805 -0.813 . . . . 20.1 108.805 -176.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.408 ' HG3' ' CHB' ' A' ' 101' ' ' HEM . 72.0 mm-40 57.63 28.21 15.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.216 0.821 . . . . 35.41 113.216 172.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.37 5.54 55.15 Favored Glycine 0 CA--C 1.501 -0.797 0 CA-C-O 119.358 -0.69 . . . . 22.73 114.767 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.6 mtp -125.27 -23.02 4.24 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 114.45 1.278 . . . . 29.88 114.45 -173.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . 1.089 ' NE2' ' CAB' ' A' ' 101' ' ' HEM . 37.4 m-70 -130.05 149.36 51.8 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 119.569 1.077 . . . . 22.13 111.131 -176.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -128.83 150.41 50.33 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.657 -1.156 . . . . 90.2 110.713 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.27 174.94 33.41 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.829 -1.308 . . . . 21.13 109.829 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.72 9.01 75.63 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 116.067 1.187 . . . . 19.5 116.067 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.9 mm -136.21 155.27 34.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 124.252 1.021 . . . . 43.87 109.041 -167.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 61.3 t0 -77.44 108.49 10.64 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.91 -1.144 . . . . 16.3 107.91 168.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 82.6 mt -97.95 20.47 12.16 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 112.571 0.582 . . . . 16.35 112.571 -174.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.0 m -57.99 -50.52 73.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.872 -0.731 . . . . 17.85 110.887 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.82 98.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.401 -0.812 . . . . 19.37 110.638 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.87 -26.48 66.05 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 121.443 -0.786 . . . . 41.41 111.502 -173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -63.71 -21.14 66.24 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 119.11 -1.036 . . . . 26.43 111.83 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -61.35 -30.33 70.45 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 119.486 -0.885 . . . . 52.53 110.222 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -95.94 -4.02 44.14 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.137 0.792 . . . . 46.69 113.137 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.93 148.79 94.49 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 120.022 -0.671 . . . . 21.54 109.676 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.19 31.88 0.52 Allowed 'Trans proline' 0 C--N 1.326 -0.632 0 C-N-CA 120.059 0.506 . . . . 31.84 113.033 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -150.01 159.69 44.2 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.055 -1.091 . . . . 21.92 108.055 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -78.67 170.5 16.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.386 -0.825 . . . . 52.26 109.259 166.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -79.03 4.04 15.59 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 112.219 0.452 . . . . 23.14 112.219 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -61.31 -22.87 65.28 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.135 0.42 . . . . 60.98 112.135 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 m -66.39 -17.74 22.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 119.961 -0.696 . . . . 25.56 112.189 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.6 mt -76.04 -21.64 56.58 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.802 0.667 . . . . 25.95 112.802 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -65.03 -24.32 67.45 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 112.878 0.696 . . . . 46.22 112.878 -166.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -78.51 -0.72 30.63 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.968 1.099 . . . . 49.42 113.968 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -116.52 144.71 33.71 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 120.152 1.342 . . . . 24.73 110.558 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.87 140.89 26.38 Favored 'Trans proline' 0 C--O 1.242 0.719 0 CA-C-O 122.633 1.014 . . . . 17.9 112.406 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 65.2 t -86.9 119.7 35.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.028 -1.442 . . . . 18.75 107.616 168.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.8 m -109.21 -1.15 9.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.093 0.957 . . . . 20.74 112.491 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 174.42 -161.77 31.79 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.135 -1.031 . . . . 21.34 112.72 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 52.6 m -134.53 138.38 44.6 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.502 -1.349 . . . . 31.07 108.59 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 53.5 tp -87.39 113.44 23.11 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 107.304 -1.369 . . . . 21.8 107.304 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.492 -1.264 0 C-N-CA 130.112 3.365 . . . . 61.07 115.25 -169.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HEM . . . . . 1.089 ' CAB' ' NE2' ' A' ' 46' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 109.532 -0.544 . . . . 61.649999999999999 109.532 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp -81.95 -50.0 9.65 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-O 119.018 -0.515 . . . . 71.079999999999998 110.946 -165.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -112.6 152.32 29.05 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 115.944 1.831 . . . . 81.040000000000006 115.944 -161.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -99.97 132.45 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.392 1.077 . . . . 75.480000000000004 111.479 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -120.51 134.74 55.24 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.037 -1.097 . . . . 24.32 108.037 -172.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.1 p -82.21 171.6 14.1 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.242 -0.983 . . . . 24.149999999999999 109.622 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.4 m -55.37 -48.7 73.87 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-N 115.707 -0.679 . . . . 24.030000000000001 111.339 175.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.84 -42.32 98.9 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.641 -0.254 . . . . 78.040000000000006 111.571 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -63.76 -46.85 83.44 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-O 121.549 0.69 . . . . 37.439999999999998 111.129 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.02 -35.41 71.22 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.282 -0.567 . . . . 17.82 110.781 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.48 -20.8 61.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 112.594 0.591 . . . . 18.940000000000001 112.594 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.19 -30.51 69.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 119.675 -0.81 . . . . 53.829999999999998 112.282 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -94.92 68.29 3.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 122.737 1.256 . . . . 25.370000000000001 109.316 -169.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -107.15 16.86 23.65 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 114.138 -1.392 . . . . 30.93 112.186 -174.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.14 7.43 87.68 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.764 -1.684 . . . . 23.109999999999999 115.682 173.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -123.07 152.88 40.59 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 118.467 1.133 . . . . 50.979999999999997 111.405 -176.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 66.56 35.6 5.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.492 -0.776 . . . . 55.469999999999999 111.642 167.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.1 -0.9 87.69 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.469 -1.348 . . . . 19.690000000000001 115.037 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -92.14 143.52 26.35 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.762 1.281 . . . . 35.340000000000003 111.329 173.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -65.78 164.87 13.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.408 0.623 . . . . 23.620000000000001 110.543 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.6 t -105.8 102.59 12.02 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.608 -0.724 . . . . 19.829999999999998 109.468 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -108.76 154.13 22.5 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.451 1.101 . . . . 17.620000000000001 109.279 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -145.13 167.81 21.84 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.991 -0.744 . . . . 17.390000000000001 108.991 163.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HB3' ' HA ' ' A' ' 51' ' ' ASP . . . -109.36 146.31 34.6 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.986 0.898 . . . . 15.050000000000001 110.011 175.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -147.43 115.33 6.47 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.543 -1.28 . . . . 22.289999999999999 107.543 175.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 48.57 51.67 15.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 122.011 0.91 . . . . 43.630000000000003 111.211 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.56 -14.32 41.92 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 116.202 1.241 . . . . 18.120000000000001 116.202 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmm -97.81 138.88 34.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.651 1.225 . . . . 29.640000000000001 109.958 -176.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.5 t -101.05 118.28 47.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 107.887 -1.153 . . . . 17.190000000000001 107.887 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -101.63 146.8 27.21 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.824 0.85 . . . . 16.199999999999999 109.637 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -105.22 109.33 21.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.746 -0.835 . . . . 22.449999999999999 108.746 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.2 m -112.38 19.6 6.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 C-N-CA 120.86 -0.336 . . . . 17.32 111.234 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.1 m -50.57 -33.21 21.04 Favored 'General case' 0 C--O 1.241 0.609 0 O-C-N 122.161 -0.337 . . . . 22.760000000000002 111.708 -174.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -80.95 -15.49 56.12 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 125.286 1.434 . . . . 70.219999999999999 113.752 -175.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -70.34 132.96 46.45 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-N 119.099 0.863 . . . . 25.84 110.594 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 2.8 mtm -65.49 -16.45 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 124.89 112.426 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -94.66 3.16 55.41 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.826 1.047 . . . . 38.289999999999999 113.826 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -121.96 32.19 5.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.272 0.487 . . . . 22.84 110.984 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -64.35 135.3 56.03 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.356 0.598 . . . . 74.280000000000001 109.621 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.0 t0 56.48 21.59 5.75 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.353 -0.84 . . . . 57.200000000000003 111.823 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.09 17.78 79.58 Favored Glycine 0 C--N 1.335 0.485 0 CA-C-O 119.544 -0.587 . . . . 24.359999999999999 113.899 175.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -114.65 127.96 56.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.478 -1.305 . . . . 33.380000000000003 107.478 -177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -114.79 106.53 14.31 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.805 -0.813 . . . . 20.100000000000001 108.805 -176.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.408 ' HG3' ' CHB' ' A' ' 101' ' ' HEM . 72.0 mm-40 57.63 28.21 15.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 113.216 0.821 . . . . 35.409999999999997 113.216 172.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.37 5.54 55.15 Favored Glycine 0 CA--C 1.501 -0.797 0 CA-C-O 119.358 -0.69 . . . . 22.73 114.767 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.6 mtp -125.27 -23.02 4.24 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 114.45 1.278 . . . . 29.879999999999999 114.45 -173.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . 1.089 ' NE2' ' CAB' ' A' ' 101' ' ' HEM . 37.4 m-70 -130.05 149.36 51.8 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 119.569 1.077 . . . . 22.129999999999999 111.131 -176.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -128.83 150.41 50.33 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.657 -1.156 . . . . 90.200000000000003 110.713 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.27 174.94 33.41 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.829 -1.308 . . . . 21.129999999999999 109.829 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.72 9.01 75.63 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 116.067 1.187 . . . . 19.5 116.067 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.9 mm -136.21 155.27 34.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 124.252 1.021 . . . . 43.869999999999997 109.041 -167.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 61.3 t0 -77.44 108.49 10.64 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.91 -1.144 . . . . 16.300000000000001 107.91 168.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 82.6 mt -97.95 20.47 12.16 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 112.571 0.582 . . . . 16.350000000000001 112.571 -174.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.0 m -57.99 -50.52 73.13 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.872 -0.731 . . . . 17.850000000000001 110.887 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.82 98.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.401 -0.812 . . . . 19.370000000000001 110.638 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.87 -26.48 66.05 Favored 'General case' 0 CA--C 1.512 -0.499 0 O-C-N 121.443 -0.786 . . . . 41.409999999999997 111.502 -173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -63.71 -21.14 66.24 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 119.11 -1.036 . . . . 26.43 111.83 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -61.35 -30.33 70.45 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 119.486 -0.885 . . . . 52.530000000000001 110.222 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -95.94 -4.02 44.14 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 113.137 0.792 . . . . 46.689999999999998 113.137 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.93 148.79 94.49 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 120.022 -0.671 . . . . 21.539999999999999 109.676 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.19 31.88 0.52 Allowed 'Trans proline' 0 C--N 1.326 -0.632 0 C-N-CA 120.059 0.506 . . . . 31.84 113.033 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -150.01 159.69 44.2 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.055 -1.091 . . . . 21.920000000000002 108.055 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -78.67 170.5 16.56 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.386 -0.825 . . . . 52.259999999999998 109.259 166.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -79.03 4.04 15.59 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 112.219 0.452 . . . . 23.140000000000001 112.219 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -61.31 -22.87 65.28 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.135 0.42 . . . . 60.979999999999997 112.135 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 m -66.39 -17.74 22.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 C-N-CA 119.961 -0.696 . . . . 25.559999999999999 112.189 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.6 mt -76.04 -21.64 56.58 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.802 0.667 . . . . 25.949999999999999 112.802 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -65.03 -24.32 67.45 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 112.878 0.696 . . . . 46.219999999999999 112.878 -166.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -78.51 -0.72 30.63 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.968 1.099 . . . . 49.420000000000002 113.968 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -116.52 144.71 33.71 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 120.152 1.342 . . . . 24.73 110.558 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.87 140.89 26.38 Favored 'Trans proline' 0 C--O 1.242 0.719 0 CA-C-O 122.633 1.014 . . . . 17.899999999999999 112.406 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 65.2 t -86.9 119.7 35.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.028 -1.442 . . . . 18.75 107.616 168.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.8 m -109.21 -1.15 9.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.093 0.957 . . . . 20.739999999999998 112.491 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 174.42 -161.77 31.79 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.135 -1.031 . . . . 21.34 112.72 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 52.6 m -134.53 138.38 44.6 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.502 -1.349 . . . . 31.07 108.59 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 53.5 tp -87.39 113.44 23.11 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 107.304 -1.369 . . . . 21.800000000000001 107.304 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.492 -1.264 0 C-N-CA 130.112 3.365 . . . . 61.07 115.25 -169.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HEM . . . . . 1.089 ' CAB' ' NE2' ' A' ' 46' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_