data_6hfa_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 6hfa _Structure_validation_residue.Date_analyzed 2020-07-03 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 ' 25' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 204' ' ' HOH . 19.4 pt-20 . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 121.423 0.63 . . . . 91.89 110.837 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.3 m -128.33 129.9 46.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.299 -1.371 . . . . 52.2 107.299 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.4 mt -93.13 131.4 38.21 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.331 -1.359 . . . . 43.94 107.331 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.69 152.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.007 0.908 . . . . 35.38 109.697 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -119.24 104.74 45.5 Favored Pre-proline 0 C--O 1.246 0.873 0 N-CA-C 106.095 -1.817 . . . . 33.15 106.095 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.73 138.98 86.43 Favored 'Trans proline' 0 N--CA 1.475 0.441 0 C-N-CA 120.609 0.873 . . . . 31.04 112.618 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -70.93 167.37 29.24 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.098 -0.955 . . . . 55.78 108.611 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -55.61 -42.37 68.33 Favored 'Trans proline' 0 N--CA 1.478 0.584 0 N-CA-C 117.167 1.949 . . . . 37.93 117.167 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -68.99 -44.27 73.19 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 120.522 1.51 . . . . 41.07 111.265 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.6 tp -61.19 -41.85 97.54 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.536 -0.866 . . . . 31.6 110.695 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.2 tp -61.45 -40.51 94.76 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.042 -0.663 . . . . 38.43 111.74 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.21 -42.39 81.25 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.477 -0.489 . . . . 40.75 111.212 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 tt -61.57 -45.89 92.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.663 -0.415 . . . . 49.62 111.623 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.7 mt -64.7 -40.12 94.82 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.803 -0.759 . . . . 36.18 111.558 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 203' ' ' HOH . 80.6 mttt -69.97 -20.4 63.31 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 120.17 -0.612 . . . . 71.33 112.261 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.3 m -64.16 -26.87 68.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 111.83 0.307 . . . . 47.83 111.83 175.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.7 m -112.21 23.61 4.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 118.217 0.462 . . . . 35.25 111.357 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.07 6.63 56.82 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 117.675 1.83 . . . . 34.28 117.675 167.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.13 143.74 56.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.436 1.618 . . . . 39.85 110.782 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -126.47 16.52 7.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.055 -0.52 . . . . 64.37 112.326 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.538 ' NZ ' ' OE2' ' A' ' 52' ' ' GLU . 79.7 mttt -116.01 170.74 8.26 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 123.126 1.441 . . . . 53.49 113.049 -171.551 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -99.47 -31.22 11.75 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 113.53 -1.668 . . . . 35.53 111.141 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.5 m -127.94 139.13 52.77 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.447 -0.946 . . . . 35.8 108.447 -171.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -138.74 161.18 37.84 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.795 -1.187 . . . . 38.47 107.795 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.0 p -81.24 159.9 24.42 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 117.866 -1.534 . . . . 43.82 109.249 159.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 16.5 tpt -58.43 -42.27 86.91 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.675 -0.693 . . . . 58.35 111.538 173.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.68 -43.24 89.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.485 -0.486 . . . . 39.15 111.063 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . 0.538 ' OE2' ' NZ ' ' A' ' 45' ' ' LYS . 52.3 tt0 -59.51 -46.53 88.59 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 122.616 0.366 . . . . 56.71 111.335 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.39 -42.31 90.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.961 0.41 . . . . 31.81 110.444 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 67.7 mt -62.06 -39.67 93.17 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.949 -0.7 . . . . 37.53 110.869 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -68.19 -42.01 80.56 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.207 -0.597 . . . . 35.22 111.661 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -62.05 -40.24 95.07 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.506 -0.478 . . . . 38.13 111.366 176.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 tp -65.18 -41.47 94.57 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.602 -0.439 . . . . 37.26 111.313 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.21 -43.07 99.86 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 119.375 -1.393 . . . . 25.83 112.216 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -58.9 -39.16 80.63 Favored 'General case' 0 CA--C 1.522 -0.126 0 O-C-N 122.456 -0.438 . . . . 31.36 111.47 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -60.41 -47.12 87.46 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.465 -0.494 . . . . 29.6 110.557 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.5 -39.67 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 O-C-N 121.954 -0.466 . . . . 33.22 111.271 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 42.7 mtm -73.25 -44.32 59.64 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.865 -0.734 . . . . 30.96 111.539 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.0 m -61.27 -36.51 80.23 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.875 0.369 . . . . 40.14 110.836 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -89.29 -1.41 58.06 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.499 0.925 . . . . 46.11 113.499 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 22.5 mtt-85 53.62 44.75 29.32 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.934 0.788 . . . . 42.76 111.785 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.3 mt -80.48 -11.1 59.72 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.761 0.652 . . . . 33.78 112.761 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -80.8 150.12 29.33 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.476 0.655 . . . . 37.98 110.644 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -71.47 133.06 45.61 Favored 'General case' 0 C--N 1.335 -0.059 0 CA-C-N 115.928 -0.578 . . . . 51.23 110.157 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -69.75 -26.83 64.5 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 118.711 -1.196 . . . . 83.03 112.142 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -89.24 -45.87 9.21 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.653 0.612 . . . . 55.14 112.653 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -118.75 89.63 3.17 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 106.633 -1.618 . . . . 50.98 106.633 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -76.58 1.18 17.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.379 0.881 . . . . 32.61 113.379 -162.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -81.94 -7.1 59.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 118.643 -1.223 . . . . 44.87 112.507 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 62.8 mt -90.15 130.39 39.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.43 -0.952 . . . . 34.21 108.43 179.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 99.7 t -118.12 120.28 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 107.884 -1.154 . . . . 34.75 107.884 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -104.98 118.41 36.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.663 -0.866 . . . . 48.97 108.663 174.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 7.6 p -132.43 20.65 4.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 39.93 111.657 -167.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -63.17 -40.93 98.95 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.026 0.75 . . . . 59.4 113.026 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -106.8 47.42 0.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 118.351 -1.34 . . . . 60.35 109.529 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -140.67 155.36 46.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.481 0.658 . . . . 35.9 109.532 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.0 tp -49.66 -37.12 27.16 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.662 -1.153 . . . . 58.5 112.106 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.82 -36.64 83.85 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 122.101 -0.374 . . . . 39.73 111.885 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.56 -39.17 96.58 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.43 -0.891 . . . . 32.85 113.557 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -61.55 -43.52 98.71 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 117.376 0.588 . . . . 59.71 111.008 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.63 -44.54 93.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.334 -0.394 . . . . 46.14 111.033 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -88.66 -17.59 29.71 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.11 0.781 . . . . 65.38 113.11 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 70.21 30.28 69.68 Favored Glycine 0 CA--C 1.507 -0.423 0 C-N-CA 120.164 -1.017 . . . . 51.86 113.164 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 155.47 31.09 Favored Pre-proline 0 N--CA 1.45 -0.426 0 N-CA-C 107.567 -1.272 . . . . 45.77 107.567 -176.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.3 -15.55 11.32 Favored 'Trans proline' 0 C--O 1.239 0.528 0 N-CA-C 113.674 0.605 . . . . 41.19 113.674 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 67.8 p -163.51 160.35 23.1 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.839 -0.8 . . . . 47.83 108.839 -170.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -160.65 163.15 32.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.335 -0.987 . . . . 35.67 108.335 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.9 t -104.79 140.88 37.45 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.318 -0.856 . . . . 35.76 109.466 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -57.97 -20.04 13.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.953 -0.567 . . . . 34.18 110.939 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -70.78 -16.48 62.75 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 121.894 -0.504 . . . . 71.86 112.185 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -83.62 66.1 8.81 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.061 1.41 . . . . 43.76 110.772 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -50.63 -49.52 56.6 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 113.928 -1.487 . . . . 52.53 111.904 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.4 ttp-105 -62.82 -43.22 99.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.444 -0.503 . . . . 61.58 111.041 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.97 -39.87 94.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 121.015 -0.274 . . . . 53.25 111.723 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 85.2 mt -69.46 -44.88 79.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.043 -0.663 . . . . 31.37 110.789 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -61.16 -45.26 95.38 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.68 -0.808 . . . . 46.62 111.333 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.1 m -58.51 -46.96 85.68 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.931 -0.308 . . . . 46.12 111.654 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 20.1 mmt -62.67 -40.13 96.12 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.6 -0.84 . . . . 66.31 111.275 -179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 94.3 mt -63.28 -47.02 94.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 118.845 -1.142 . . . . 36.87 110.606 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -63.35 -33.3 75.22 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.33 -0.548 . . . . 51.63 111.912 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -67.15 -12.29 59.6 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 118.847 -1.141 . . . . 41.48 112.567 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -117.56 23.77 11.53 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.211 0.819 . . . . 36.85 113.211 -175.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.3 pp -142.92 163.91 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.815 0.816 . . . . 34.77 109.76 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.4 t -111.38 126.52 68.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.068 -1.456 . . . . 42.12 107.068 170.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 41.3 t -76.79 135.76 26.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.107 -0.497 . . . . 56.49 109.94 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.7 t -94.38 95.07 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 106.682 -1.599 . . . . 59.22 106.682 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . 0.708 ' OXT' ' O ' ' A' ' 201' ' ' HOH . 23.6 t30 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.312 0.577 . . . . 75.9 109.7 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.224 0.535 . . . . 92.35 112.24 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -77.5 130.22 36.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.715 -0.675 . . . . 68.97 110.077 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 50.8 mt -98.81 144.21 28.29 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.041 0.936 . . . . 41.66 111.453 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -123.8 154.68 30.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 122.092 0.949 . . . . 34.06 108.748 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -117.51 103.88 50.44 Favored Pre-proline 0 C--O 1.245 0.853 0 CA-C-N 115.16 -0.927 . . . . 35.74 109.694 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -60.45 141.07 94.59 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 C-N-CA 120.24 0.627 . . . . 33.86 111.607 177.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -69.29 164.23 50.75 Favored Pre-proline 0 N--CA 1.448 -0.565 0 CA-C-N 115.158 -0.928 . . . . 62.52 109.588 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -56.24 -42.52 65.26 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 115.967 1.487 . . . . 36.89 115.967 -167.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.32 -45.62 72.45 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 119.877 1.217 . . . . 55.16 111.57 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 46.5 tp -58.9 -40.34 84.18 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.414 -0.515 . . . . 30.86 110.977 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 33.8 tp -61.73 -40.74 96.16 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.247 -0.581 . . . . 36.67 111.147 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.82 -43.69 85.91 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.054 0.39 . . . . 44.19 112.054 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 21.2 mt -62.45 -44.6 96.02 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.336 -0.545 . . . . 38.58 111.349 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 67.5 mt -64.02 -41.12 97.55 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.432 -0.907 . . . . 36.32 110.931 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -69.67 -21.63 63.51 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 118.726 -1.189 . . . . 46.16 112.261 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 53.5 p -66.88 -18.11 65.22 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.016 0.747 . . . . 34.83 113.016 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 17.9 m -112.2 22.91 5.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 119.214 0.916 . . . . 34.39 111.089 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.3 3.9 56.46 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 115.636 1.015 . . . . 33.1 115.636 168.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.64 148.04 49.98 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.996 -1.481 . . . . 39.46 108.214 172.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -120.3 -30.58 4.57 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.631 0.974 . . . . 54.03 113.631 -171.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -84.68 173.38 10.77 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.013 1.325 . . . . 58.04 110.334 -172.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -105.4 -17.11 14.55 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.652 0.982 . . . . 53.68 113.652 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 54.1 p -128.96 140.71 51.54 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.321 1.049 . . . . 36.21 109.012 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -141.05 165.22 28.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.668 0.746 . . . . 39.54 110.822 -170.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 58.6 p -76.94 158.87 30.4 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 116.307 -2.157 . . . . 39.69 108.728 160.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 13.4 tpt -57.4 -41.35 80.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 58.39 110.973 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.74 -42.61 89.19 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.01 -0.676 . . . . 37.67 111.014 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -60.5 -48.87 79.87 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 122.088 -0.382 . . . . 59.25 111.794 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.1 m -60.81 -41.81 90.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 119.122 -1.031 . . . . 44.13 110.912 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.992 -0.683 . . . . 41.92 110.69 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -67.09 -43.98 81.17 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.106 -1.038 . . . . 38.0 110.934 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -61.78 -39.63 92.37 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.834 -0.746 . . . . 43.76 111.517 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.61 -42.78 86.3 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.186 -0.606 . . . . 35.79 111.801 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.16 98.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 119.499 -1.334 . . . . 26.71 111.764 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -58.76 -41.06 85.69 Favored 'General case' 0 C--O 1.24 0.591 0 O-C-N 122.297 -0.531 . . . . 30.54 111.11 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -59.64 -47.58 85.03 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.746 0.308 . . . . 32.62 111.297 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 58.4 mt -58.86 -37.67 68.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-O 121.064 0.459 . . . . 30.95 110.371 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 37.2 mtm -72.0 -40.62 68.39 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.99 -0.684 . . . . 33.82 111.714 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -62.98 -35.49 80.36 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.645 -0.822 . . . . 40.22 112.034 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -87.76 0.18 56.1 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 121.485 -0.759 . . . . 63.07 112.432 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 49.68 46.38 23.83 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.575 0.702 . . . . 50.71 112.59 -179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 71.3 mt -78.67 -10.24 59.68 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.888 0.699 . . . . 33.79 112.888 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -77.38 144.2 38.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.597 0.635 . . . . 34.95 110.604 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.99 138.82 54.85 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.073 -0.714 . . . . 54.13 109.073 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.35 -32.07 70.9 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 119.134 -1.027 . . . . 50.71 112.79 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . . . -92.59 -42.97 9.37 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.311 0.856 . . . . 47.93 113.311 -177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . . . -115.3 86.16 2.41 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.195 -1.779 . . . . 45.79 106.195 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -76.16 -1.28 25.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 113.92 1.082 . . . . 33.83 113.92 -163.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -78.91 -8.8 59.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 118.465 -1.294 . . . . 41.32 112.134 168.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 72.9 mt -92.83 131.15 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.626 -0.879 . . . . 51.24 108.626 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -116.08 124.64 72.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 123.904 0.882 . . . . 36.34 108.698 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -103.29 116.22 32.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.82 -0.807 . . . . 68.03 108.82 173.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.57 15.89 5.96 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.923 0.712 . . . . 42.71 112.923 -171.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 28.0 p -66.59 -26.08 66.93 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.538 -0.865 . . . . 57.92 110.997 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 47.3 p-10 -97.49 23.7 7.39 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.452 0.538 . . . . 51.37 112.452 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -138.97 151.52 46.93 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.236 -0.653 . . . . 42.49 109.236 -176.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 21.8 mt -51.55 -30.02 19.09 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.428 -0.805 . . . . 55.76 112.253 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.04 -35.92 74.12 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.873 -0.731 . . . . 40.75 111.509 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.05 -40.21 96.87 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.257 -0.973 . . . . 42.81 112.739 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -61.09 -43.05 99.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.624 -0.831 . . . . 70.39 110.115 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 13.6 tp -59.58 -49.77 76.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.958 0.409 . . . . 62.86 111.89 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -87.13 -15.52 38.18 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.276 0.843 . . . . 46.61 113.276 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 74.26 31.19 59.64 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 115.983 1.153 . . . . 53.4 115.983 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 152.11 25.94 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-N 118.116 0.958 . . . . 52.64 108.968 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -80.13 -15.04 11.81 Favored 'Trans proline' 0 C--O 1.242 0.72 0 O-C-N 122.087 0.519 . . . . 42.77 113.205 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 73.8 p -164.4 160.88 21.19 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.447 -0.946 . . . . 46.53 108.447 -175.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 55.7 p90 -160.79 161.53 32.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.939 -0.763 . . . . 42.44 108.939 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 42.0 t -105.15 134.26 48.54 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.74 -0.664 . . . . 39.14 109.588 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -60.45 -21.06 22.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.92 -0.582 . . . . 44.03 110.982 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -70.42 -18.91 63.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.5 -0.88 . . . . 53.28 111.946 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -87.02 67.68 9.84 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.13 0.967 . . . . 71.56 108.75 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -54.53 -51.2 65.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.69 -1.141 . . . . 66.41 111.829 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . . . -60.17 -43.17 96.03 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 121.056 -0.258 . . . . 42.35 111.659 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.1 -36.9 85.53 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.704 -0.398 . . . . 41.62 111.234 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ILE . . . . . . . . . . . . . 89.6 mt -68.05 -42.79 85.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 118.734 -1.186 . . . . 42.31 110.071 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -59.45 -42.91 93.04 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.922 -0.311 . . . . 43.58 111.367 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.9 m -58.02 -45.81 86.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.654 -0.418 . . . . 36.08 110.902 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' MET . . . . . . . . . . . . . 66.0 mtm -64.65 -40.66 95.83 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 119.527 -0.869 . . . . 48.56 110.963 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.52 -43.2 98.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 120.535 -0.466 . . . . 34.4 110.901 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.46 -27.71 69.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.245 -0.582 . . . . 43.2 111.925 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . 0.555 ' NH1' ' O ' ' B' ' 201' ' ' HOH . 97.0 mtt180 -66.81 -13.31 61.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.451 -0.5 . . . . 68.63 112.006 173.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -117.48 18.18 14.37 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 118.072 0.396 . . . . 40.25 111.741 -176.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 66.9 mt -139.03 152.67 47.79 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 123.368 0.667 . . . . 51.66 109.272 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 90.1 t -122.24 132.85 70.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.431 -0.952 . . . . 43.46 108.431 169.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 41.1 t -72.88 135.59 27.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 108.973 -0.751 . . . . 41.55 108.973 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 45.1 t -88.49 -52.12 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.281 -0.418 . . . . 50.75 112.034 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 27.0 p30 . . . . . 0 C--N 1.327 -0.41 0 O-C-N 121.97 -0.456 . . . . 87.14 110.682 -177.391 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.342 0.591 . . . . 47.31 109.606 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' SER . . . . . . . . . . . . . 88.3 p -73.11 157.25 37.63 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 122.045 0.926 . . . . 32.28 111.472 -175.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -53.06 -40.1 63.76 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.111 -0.95 . . . . 31.29 110.967 167.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.98 -40.29 80.29 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.833 -0.747 . . . . 28.96 111.307 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -72.15 -38.93 69.08 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.305 -0.558 . . . . 46.03 111.441 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -62.07 -42.63 99.4 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 119.635 -0.826 . . . . 46.43 110.651 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' TRP . . . . . . . . . . . . . 65.6 t-105 . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 109.424 -0.584 . . . . 39.11 109.424 -174.775 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 44.7 m . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.15 0.5 . . . . 53.37 111.034 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -72.46 156.45 39.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.129 -0.941 . . . . 32.06 110.978 -176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -53.51 -41.72 66.62 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.058 -0.974 . . . . 31.33 111.004 168.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.32 80.26 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.382 -0.527 . . . . 26.96 111.337 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -70.37 -38.58 74.78 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.429 -0.508 . . . . 57.04 111.337 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -62.45 -43.45 98.78 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.514 -0.874 . . . . 45.48 111.364 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 . . . . . 0 N--CA 1.438 -1.041 0 O-C-N 122.376 -0.203 . . . . 37.85 110.902 -173.825 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.708 ' O ' ' OXT' ' A' ' 111' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.561 ' O ' ' NZ ' ' A' ' 39' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.513 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.555 ' O ' ' NH1' ' B' ' 105' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 204' ' ' HOH . 19.4 pt-20 . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 121.423 0.63 . . . . 91.890000000000001 110.837 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.3 m -128.33 129.9 46.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.299 -1.371 . . . . 52.200000000000003 107.299 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.4 mt -93.13 131.4 38.21 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.331 -1.359 . . . . 43.939999999999998 107.331 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.69 152.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.007 0.908 . . . . 35.380000000000003 109.697 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -119.24 104.74 45.5 Favored Pre-proline 0 C--O 1.246 0.873 0 N-CA-C 106.095 -1.817 . . . . 33.149999999999999 106.095 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.73 138.98 86.43 Favored 'Trans proline' 0 N--CA 1.475 0.441 0 C-N-CA 120.609 0.873 . . . . 31.039999999999999 112.618 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -70.93 167.37 29.24 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.098 -0.955 . . . . 55.780000000000001 108.611 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -55.61 -42.37 68.33 Favored 'Trans proline' 0 N--CA 1.478 0.584 0 N-CA-C 117.167 1.949 . . . . 37.93 117.167 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -68.99 -44.27 73.19 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 120.522 1.51 . . . . 41.07 111.265 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.6 tp -61.19 -41.85 97.54 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.536 -0.866 . . . . 31.600000000000001 110.695 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.2 tp -61.45 -40.51 94.76 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.042 -0.663 . . . . 38.43 111.74 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.21 -42.39 81.25 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.477 -0.489 . . . . 40.75 111.212 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 tt -61.57 -45.89 92.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.663 -0.415 . . . . 49.619999999999997 111.623 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.424 HD22 ' HB3' ' A' ' 56' ' ' TYR . 62.7 mt -64.7 -40.12 94.82 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.803 -0.759 . . . . 36.18 111.558 179.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -69.97 -20.4 63.31 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 120.17 -0.612 . . . . 71.329999999999998 112.261 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.3 m -64.16 -26.87 68.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 111.83 0.307 . . . . 47.829999999999998 111.83 175.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HA ' ' A' ' 60' ' ' TYR . 11.7 m -112.21 23.61 4.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 118.217 0.462 . . . . 35.25 111.357 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.07 6.63 56.82 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 117.675 1.83 . . . . 34.280000000000001 117.675 167.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.13 143.74 56.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.436 1.618 . . . . 39.850000000000001 110.782 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -126.47 16.52 7.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.055 -0.52 . . . . 64.370000000000005 112.326 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -116.01 170.74 8.26 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 123.126 1.441 . . . . 53.490000000000002 113.049 -171.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -99.47 -31.22 11.75 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 113.53 -1.668 . . . . 35.530000000000001 111.141 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.5 m -127.94 139.13 52.77 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.447 -0.946 . . . . 35.799999999999997 108.447 -171.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -138.74 161.18 37.84 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.795 -1.187 . . . . 38.469999999999999 107.795 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.0 p -81.24 159.9 24.42 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 117.866 -1.534 . . . . 43.82 109.249 159.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 16.5 tpt -58.43 -42.27 86.91 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.675 -0.693 . . . . 58.350000000000001 111.538 173.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.68 -43.24 89.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.485 -0.486 . . . . 39.149999999999999 111.063 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -59.51 -46.53 88.59 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 122.616 0.366 . . . . 56.710000000000001 111.335 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.39 -42.31 90.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.961 0.41 . . . . 31.809999999999999 110.444 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 67.7 mt -62.06 -39.67 93.17 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.949 -0.7 . . . . 37.530000000000001 110.869 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -68.19 -42.01 80.56 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.207 -0.597 . . . . 35.219999999999999 111.661 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 38' ' ' LEU . 11.0 m-85 -62.05 -40.24 95.07 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.506 -0.478 . . . . 38.130000000000003 111.366 176.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 tp -65.18 -41.47 94.57 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.602 -0.439 . . . . 37.259999999999998 111.313 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.21 -43.07 99.86 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 119.375 -1.393 . . . . 25.829999999999998 112.216 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -58.9 -39.16 80.63 Favored 'General case' 0 CA--C 1.522 -0.126 0 O-C-N 122.456 -0.438 . . . . 31.359999999999999 111.47 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . 0.452 ' HA ' HG11 ' A' ' 41' ' ' VAL . 74.6 t80 -60.41 -47.12 87.46 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.465 -0.494 . . . . 29.600000000000001 110.557 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.5 -39.67 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 O-C-N 121.954 -0.466 . . . . 33.219999999999999 111.271 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 42.7 mtm -73.25 -44.32 59.64 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.865 -0.734 . . . . 30.960000000000001 111.539 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.0 m -61.27 -36.51 80.23 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.875 0.369 . . . . 40.140000000000001 110.836 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -89.29 -1.41 58.06 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.499 0.925 . . . . 46.109999999999999 113.499 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 22.5 mtt-85 53.62 44.75 29.32 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.934 0.788 . . . . 42.759999999999998 111.785 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.3 mt -80.48 -11.1 59.72 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.761 0.652 . . . . 33.780000000000001 112.761 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -80.8 150.12 29.33 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.476 0.655 . . . . 37.979999999999997 110.644 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -71.47 133.06 45.61 Favored 'General case' 0 C--N 1.335 -0.059 0 CA-C-N 115.928 -0.578 . . . . 51.229999999999997 110.157 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -69.75 -26.83 64.5 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 118.711 -1.196 . . . . 83.030000000000001 112.142 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -89.24 -45.87 9.21 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.653 0.612 . . . . 55.140000000000001 112.653 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -118.75 89.63 3.17 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 106.633 -1.618 . . . . 50.979999999999997 106.633 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -76.58 1.18 17.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.379 0.881 . . . . 32.609999999999999 113.379 -162.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -81.94 -7.1 59.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 118.643 -1.223 . . . . 44.869999999999997 112.507 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 62.8 mt -90.15 130.39 39.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.43 -0.952 . . . . 34.210000000000001 108.43 179.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 99.7 t -118.12 120.28 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 107.884 -1.154 . . . . 34.75 107.884 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -104.98 118.41 36.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.663 -0.866 . . . . 48.969999999999999 108.663 174.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 7.6 p -132.43 20.65 4.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 39.93 111.657 -167.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -63.17 -40.93 98.95 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.026 0.75 . . . . 59.399999999999999 113.026 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -106.8 47.42 0.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 118.351 -1.34 . . . . 60.350000000000001 109.529 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -140.67 155.36 46.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.481 0.658 . . . . 35.899999999999999 109.532 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.0 tp -49.66 -37.12 27.16 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.662 -1.153 . . . . 58.5 112.106 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.82 -36.64 83.85 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 122.101 -0.374 . . . . 39.729999999999997 111.885 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.56 -39.17 96.58 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.43 -0.891 . . . . 32.850000000000001 113.557 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -61.55 -43.52 98.71 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 117.376 0.588 . . . . 59.710000000000001 111.008 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.63 -44.54 93.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.334 -0.394 . . . . 46.140000000000001 111.033 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -88.66 -17.59 29.71 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.11 0.781 . . . . 65.379999999999995 113.11 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 70.21 30.28 69.68 Favored Glycine 0 CA--C 1.507 -0.423 0 C-N-CA 120.164 -1.017 . . . . 51.859999999999999 113.164 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 155.47 31.09 Favored Pre-proline 0 N--CA 1.45 -0.426 0 N-CA-C 107.567 -1.272 . . . . 45.770000000000003 107.567 -176.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.3 -15.55 11.32 Favored 'Trans proline' 0 C--O 1.239 0.528 0 N-CA-C 113.674 0.605 . . . . 41.189999999999998 113.674 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 67.8 p -163.51 160.35 23.1 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.839 -0.8 . . . . 47.829999999999998 108.839 -170.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -160.65 163.15 32.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.335 -0.987 . . . . 35.670000000000002 108.335 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.9 t -104.79 140.88 37.45 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.318 -0.856 . . . . 35.759999999999998 109.466 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -57.97 -20.04 13.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.953 -0.567 . . . . 34.18 110.939 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -70.78 -16.48 62.75 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 121.894 -0.504 . . . . 71.859999999999999 112.185 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -83.62 66.1 8.81 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.061 1.41 . . . . 43.759999999999998 110.772 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -50.63 -49.52 56.6 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 113.928 -1.487 . . . . 52.530000000000001 111.904 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.4 ttp-105 -62.82 -43.22 99.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.444 -0.503 . . . . 61.579999999999998 111.041 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.97 -39.87 94.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 121.015 -0.274 . . . . 53.25 111.723 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 85.2 mt -69.46 -44.88 79.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.043 -0.663 . . . . 31.370000000000001 110.789 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -61.16 -45.26 95.38 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.68 -0.808 . . . . 46.619999999999997 111.333 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.1 m -58.51 -46.96 85.68 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.931 -0.308 . . . . 46.119999999999997 111.654 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 20.1 mmt -62.67 -40.13 96.12 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.6 -0.84 . . . . 66.310000000000002 111.275 -179.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 94.3 mt -63.28 -47.02 94.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 118.845 -1.142 . . . . 36.869999999999997 110.606 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -63.35 -33.3 75.22 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.33 -0.548 . . . . 51.630000000000003 111.912 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -67.15 -12.29 59.6 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 118.847 -1.141 . . . . 41.479999999999997 112.567 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -117.56 23.77 11.53 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.211 0.819 . . . . 36.850000000000001 113.211 -175.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.3 pp -142.92 163.91 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.815 0.816 . . . . 34.770000000000003 109.76 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.4 t -111.38 126.52 68.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.068 -1.456 . . . . 42.119999999999997 107.068 170.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 41.3 t -76.79 135.76 26.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.107 -0.497 . . . . 56.490000000000002 109.94 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.7 t -94.38 95.07 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 106.682 -1.599 . . . . 59.219999999999999 106.682 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . 0.708 ' OXT' ' O ' ' A' ' 201' ' ' HOH . 23.6 t30 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.312 0.577 . . . . 75.900000000000006 109.7 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.224 0.535 . . . . 92.349999999999994 112.24 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -77.5 130.22 36.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.715 -0.675 . . . . 68.969999999999999 110.077 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 50.8 mt -98.81 144.21 28.29 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.041 0.936 . . . . 41.659999999999997 111.453 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -123.8 154.68 30.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 122.092 0.949 . . . . 34.060000000000002 108.748 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -117.51 103.88 50.44 Favored Pre-proline 0 C--O 1.245 0.853 0 CA-C-N 115.16 -0.927 . . . . 35.740000000000002 109.694 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PRO . . . . . 0.408 ' HA ' HD23 ' B' ' 107' ' ' LEU . 62.7 Cg_exo -60.45 141.07 94.59 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 C-N-CA 120.24 0.627 . . . . 33.859999999999999 111.607 177.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' B' ' 106' ' ' ASN . 67.9 mttm -69.29 164.23 50.75 Favored Pre-proline 0 N--CA 1.448 -0.565 0 CA-C-N 115.158 -0.928 . . . . 62.520000000000003 109.588 172.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -56.24 -42.52 65.26 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 115.967 1.487 . . . . 36.890000000000001 115.967 -167.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.32 -45.62 72.45 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 119.877 1.217 . . . . 55.159999999999997 111.57 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LEU . . . . . 0.404 HD13 HD21 ' B' ' 85' ' ' LEU . 46.5 tp -58.9 -40.34 84.18 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.414 -0.515 . . . . 30.859999999999999 110.977 176.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 33.8 tp -61.73 -40.74 96.16 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.247 -0.581 . . . . 36.670000000000002 111.147 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.82 -43.69 85.91 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.054 0.39 . . . . 44.189999999999998 112.054 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 21.2 mt -62.45 -44.6 96.02 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.336 -0.545 . . . . 38.579999999999998 111.349 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' B' ' 56' ' ' TYR . 67.5 mt -64.02 -41.12 97.55 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.432 -0.907 . . . . 36.32 110.931 179.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -69.67 -21.63 63.51 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 118.726 -1.189 . . . . 46.159999999999997 112.261 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 53.5 p -66.88 -18.11 65.22 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.016 0.747 . . . . 34.829999999999998 113.016 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 17.9 m -112.2 22.91 5.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 119.214 0.916 . . . . 34.390000000000001 111.089 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.3 3.9 56.46 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 115.636 1.015 . . . . 33.100000000000001 115.636 168.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.64 148.04 49.98 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.996 -1.481 . . . . 39.460000000000001 108.214 172.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -120.3 -30.58 4.57 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.631 0.974 . . . . 54.030000000000001 113.631 -171.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -84.68 173.38 10.77 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.013 1.325 . . . . 58.039999999999999 110.334 -172.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -105.4 -17.11 14.55 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.652 0.982 . . . . 53.68 113.652 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 54.1 p -128.96 140.71 51.54 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.321 1.049 . . . . 36.210000000000001 109.012 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -141.05 165.22 28.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.668 0.746 . . . . 39.539999999999999 110.822 -170.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 58.6 p -76.94 158.87 30.4 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 116.307 -2.157 . . . . 39.689999999999998 108.728 160.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 13.4 tpt -57.4 -41.35 80.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 58.390000000000001 110.973 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.74 -42.61 89.19 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.01 -0.676 . . . . 37.670000000000002 111.014 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -60.5 -48.87 79.87 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 122.088 -0.382 . . . . 59.25 111.794 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.1 m -60.81 -41.81 90.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 119.122 -1.031 . . . . 44.130000000000003 110.912 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.992 -0.683 . . . . 41.920000000000002 110.69 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -67.09 -43.98 81.17 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.106 -1.038 . . . . 38.0 110.934 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' TYR . . . . . 0.476 ' HB3' HD22 ' B' ' 38' ' ' LEU . 11.2 m-85 -61.78 -39.63 92.37 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.834 -0.746 . . . . 43.759999999999998 111.517 176.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.61 -42.78 86.3 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.186 -0.606 . . . . 35.789999999999999 111.801 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.16 98.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 119.499 -1.334 . . . . 26.710000000000001 111.764 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLN . . . . . 0.585 ' O ' HG23 ' B' ' 63' ' ' THR . 39.1 tt0 -58.76 -41.06 85.69 Favored 'General case' 0 C--O 1.24 0.591 0 O-C-N 122.297 -0.531 . . . . 30.539999999999999 111.11 176.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -59.64 -47.58 85.03 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.746 0.308 . . . . 32.619999999999997 111.297 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 58.4 mt -58.86 -37.67 68.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-O 121.064 0.459 . . . . 30.949999999999999 110.371 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 37.2 mtm -72.0 -40.62 68.39 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.99 -0.684 . . . . 33.82 111.714 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' THR . . . . . 0.585 HG23 ' O ' ' B' ' 59' ' ' GLN . 29.9 p -62.98 -35.49 80.36 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.645 -0.822 . . . . 40.219999999999999 112.034 179.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . 0.47 ' HE3' ' OD1' ' B' ' 80' ' ' ASP . 6.8 mmmt -87.76 0.18 56.1 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 121.485 -0.759 . . . . 63.07 112.432 176.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 49.68 46.38 23.83 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.575 0.702 . . . . 50.710000000000001 112.59 -179.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 71.3 mt -78.67 -10.24 59.68 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.888 0.699 . . . . 33.789999999999999 112.888 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -77.38 144.2 38.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.597 0.635 . . . . 34.950000000000003 110.604 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.99 138.82 54.85 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.073 -0.714 . . . . 54.130000000000003 109.073 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.35 -32.07 70.9 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 119.134 -1.027 . . . . 50.710000000000001 112.79 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . . . -92.59 -42.97 9.37 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.311 0.856 . . . . 47.93 113.311 -177.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . . . -115.3 86.16 2.41 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.195 -1.779 . . . . 45.789999999999999 106.195 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -76.16 -1.28 25.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 113.92 1.082 . . . . 33.829999999999998 113.92 -163.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -78.91 -8.8 59.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 118.465 -1.294 . . . . 41.32 112.134 168.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 72.9 mt -92.83 131.15 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.626 -0.879 . . . . 51.240000000000002 108.626 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -116.08 124.64 72.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 123.904 0.882 . . . . 36.340000000000003 108.698 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -103.29 116.22 32.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.82 -0.807 . . . . 68.030000000000001 108.82 173.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.57 15.89 5.96 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.923 0.712 . . . . 42.710000000000001 112.923 -171.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 28.0 p -66.59 -26.08 66.93 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.538 -0.865 . . . . 57.920000000000002 110.997 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 47.3 p-10 -97.49 23.7 7.39 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.452 0.538 . . . . 51.369999999999997 112.452 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ASP . . . . . 0.47 ' OD1' ' HE3' ' B' ' 64' ' ' LYS . 10.8 t70 -138.97 151.52 46.93 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.236 -0.653 . . . . 42.490000000000002 109.236 -176.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 21.8 mt -51.55 -30.02 19.09 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.428 -0.805 . . . . 55.759999999999998 112.253 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.04 -35.92 74.12 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.873 -0.731 . . . . 40.75 111.509 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.05 -40.21 96.87 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.257 -0.973 . . . . 42.810000000000002 112.739 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -61.09 -43.05 99.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.624 -0.831 . . . . 70.390000000000001 110.115 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 34' ' ' LEU . 13.6 tp -59.58 -49.77 76.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.958 0.409 . . . . 62.859999999999999 111.89 179.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -87.13 -15.52 38.18 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.276 0.843 . . . . 46.609999999999999 113.276 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 74.26 31.19 59.64 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 115.983 1.153 . . . . 53.399999999999999 115.983 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 152.11 25.94 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-N 118.116 0.958 . . . . 52.640000000000001 108.968 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -80.13 -15.04 11.81 Favored 'Trans proline' 0 C--O 1.242 0.72 0 O-C-N 122.087 0.519 . . . . 42.770000000000003 113.205 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 73.8 p -164.4 160.88 21.19 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.447 -0.946 . . . . 46.530000000000001 108.447 -175.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 55.7 p90 -160.79 161.53 32.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.939 -0.763 . . . . 42.439999999999998 108.939 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 42.0 t -105.15 134.26 48.54 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.74 -0.664 . . . . 39.140000000000001 109.588 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -60.45 -21.06 22.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.92 -0.582 . . . . 44.030000000000001 110.982 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -70.42 -18.91 63.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.5 -0.88 . . . . 53.280000000000001 111.946 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -87.02 67.68 9.84 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.13 0.967 . . . . 71.560000000000002 108.75 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -54.53 -51.2 65.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.69 -1.141 . . . . 66.409999999999997 111.829 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . . . -60.17 -43.17 96.03 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 121.056 -0.258 . . . . 42.350000000000001 111.659 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.1 -36.9 85.53 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.704 -0.398 . . . . 41.619999999999997 111.234 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ILE . . . . . . . . . . . . . 89.6 mt -68.05 -42.79 85.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 118.734 -1.186 . . . . 42.310000000000002 110.071 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -59.45 -42.91 93.04 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.922 -0.311 . . . . 43.579999999999998 111.367 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.9 m -58.02 -45.81 86.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.654 -0.418 . . . . 36.079999999999998 110.902 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' MET . . . . . . . . . . . . . 66.0 mtm -64.65 -40.66 95.83 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 119.527 -0.869 . . . . 48.560000000000002 110.963 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.52 -43.2 98.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 120.535 -0.466 . . . . 34.399999999999999 110.901 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.46 -27.71 69.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.245 -0.582 . . . . 43.200000000000003 111.925 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . 0.523 ' HD2' ' O ' ' B' ' 201' ' ' HOH . 97.0 mtt180 -66.81 -13.31 61.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.451 -0.5 . . . . 68.629999999999995 112.006 173.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' B' ' 31' ' ' LYS . 65.2 m-80 -117.48 18.18 14.37 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 118.072 0.396 . . . . 40.25 111.741 -176.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 30' ' ' PRO . 66.9 mt -139.03 152.67 47.79 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 123.368 0.667 . . . . 51.659999999999997 109.272 -179.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 90.1 t -122.24 132.85 70.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.431 -0.952 . . . . 43.460000000000001 108.431 169.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 41.1 t -72.88 135.59 27.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 108.973 -0.751 . . . . 41.549999999999997 108.973 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 45.1 t -88.49 -52.12 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.281 -0.418 . . . . 50.75 112.034 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 27.0 p30 . . . . . 0 C--N 1.327 -0.41 0 O-C-N 121.97 -0.456 . . . . 87.140000000000001 110.682 -177.391 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.342 0.591 . . . . 47.310000000000002 109.606 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 18' ' ' SER . . . . . . . . . . . . . 88.3 p -73.11 157.25 37.63 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 122.045 0.926 . . . . 32.280000000000001 111.472 -175.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -53.06 -40.1 63.76 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.111 -0.95 . . . . 31.289999999999999 110.967 167.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.98 -40.29 80.29 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.833 -0.747 . . . . 28.960000000000001 111.307 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -72.15 -38.93 69.08 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.305 -0.558 . . . . 46.030000000000001 111.441 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -62.07 -42.63 99.4 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 119.635 -0.826 . . . . 46.43 110.651 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' TRP . . . . . . . . . . . . . 65.6 t-105 . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 109.424 -0.584 . . . . 39.109999999999999 109.424 -174.775 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 44.7 m . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.15 0.5 . . . . 53.369999999999997 111.034 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -72.46 156.45 39.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.129 -0.941 . . . . 32.060000000000002 110.978 -176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -53.51 -41.72 66.62 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.058 -0.974 . . . . 31.329999999999998 111.004 168.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.32 80.26 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.382 -0.527 . . . . 26.960000000000001 111.337 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -70.37 -38.58 74.78 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.429 -0.508 . . . . 57.039999999999999 111.337 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -62.45 -43.45 98.78 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.514 -0.874 . . . . 45.479999999999997 111.364 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 . . . . . 0 N--CA 1.438 -1.041 0 O-C-N 122.376 -0.203 . . . . 37.850000000000001 110.902 -173.825 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.708 ' O ' ' OXT' ' A' ' 111' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.513 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.523 ' O ' ' HD2' ' B' ' 105' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 204' ' ' HOH . 19.4 pt-20 . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 121.423 0.63 . . . . 91.89 110.837 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.3 m -128.33 129.9 46.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.299 -1.371 . . . . 52.2 107.299 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.4 mt -93.13 131.4 38.21 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.331 -1.359 . . . . 43.94 107.331 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.8 m -130.69 152.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.007 0.908 . . . . 35.38 109.697 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -119.24 104.74 45.5 Favored Pre-proline 0 C--O 1.246 0.873 0 N-CA-C 106.095 -1.817 . . . . 33.15 106.095 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.73 138.98 86.43 Favored 'Trans proline' 0 N--CA 1.475 0.441 0 C-N-CA 120.609 0.873 . . . . 31.04 112.618 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -70.93 167.37 29.24 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.098 -0.955 . . . . 55.78 108.611 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -55.61 -42.37 68.33 Favored 'Trans proline' 0 N--CA 1.478 0.584 0 N-CA-C 117.167 1.949 . . . . 37.93 117.167 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -68.99 -44.27 73.19 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 120.522 1.51 . . . . 41.07 111.265 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.6 tp -61.19 -41.85 97.54 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.536 -0.866 . . . . 31.6 110.695 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.2 tp -61.45 -40.51 94.76 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.042 -0.663 . . . . 38.43 111.74 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.21 -42.39 81.25 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.477 -0.489 . . . . 40.75 111.212 175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 tt -61.57 -45.89 92.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.663 -0.415 . . . . 49.62 111.623 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.424 HD22 ' HB3' ' A' ' 56' ' ' TYR . 62.7 mt -64.7 -40.12 94.82 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.803 -0.759 . . . . 36.18 111.558 179.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -69.97 -20.4 63.31 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 120.17 -0.612 . . . . 71.33 112.261 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.3 m -64.16 -26.87 68.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 111.83 0.307 . . . . 47.83 111.83 175.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HA ' ' A' ' 60' ' ' TYR . 11.7 m -112.21 23.61 4.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 118.217 0.462 . . . . 35.25 111.357 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.07 6.63 56.82 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 117.675 1.83 . . . . 34.28 117.675 167.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.13 143.74 56.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.436 1.618 . . . . 39.85 110.782 175.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -126.47 16.52 7.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.055 -0.52 . . . . 64.37 112.326 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -116.01 170.74 8.26 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 123.126 1.441 . . . . 53.49 113.049 -171.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -99.47 -31.22 11.75 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 113.53 -1.668 . . . . 35.53 111.141 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.5 m -127.94 139.13 52.77 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.447 -0.946 . . . . 35.8 108.447 -171.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -138.74 161.18 37.84 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.795 -1.187 . . . . 38.47 107.795 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.0 p -81.24 159.9 24.42 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 117.866 -1.534 . . . . 43.82 109.249 159.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 16.5 tpt -58.43 -42.27 86.91 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.675 -0.693 . . . . 58.35 111.538 173.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.68 -43.24 89.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.485 -0.486 . . . . 39.15 111.063 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -59.51 -46.53 88.59 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 122.616 0.366 . . . . 56.71 111.335 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.39 -42.31 90.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.961 0.41 . . . . 31.81 110.444 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 67.7 mt -62.06 -39.67 93.17 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.949 -0.7 . . . . 37.53 110.869 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -68.19 -42.01 80.56 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.207 -0.597 . . . . 35.22 111.661 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.424 ' HB3' HD22 ' A' ' 38' ' ' LEU . 11.0 m-85 -62.05 -40.24 95.07 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.506 -0.478 . . . . 38.13 111.366 176.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 tp -65.18 -41.47 94.57 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.602 -0.439 . . . . 37.26 111.313 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.21 -43.07 99.86 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 119.375 -1.393 . . . . 25.83 112.216 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -58.9 -39.16 80.63 Favored 'General case' 0 CA--C 1.522 -0.126 0 O-C-N 122.456 -0.438 . . . . 31.36 111.47 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.452 ' HA ' HG11 ' A' ' 41' ' ' VAL . 74.6 t80 -60.41 -47.12 87.46 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.465 -0.494 . . . . 29.6 110.557 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.5 -39.67 85.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 O-C-N 121.954 -0.466 . . . . 33.22 111.271 -179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 42.7 mtm -73.25 -44.32 59.64 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.865 -0.734 . . . . 30.96 111.539 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.0 m -61.27 -36.51 80.23 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.875 0.369 . . . . 40.14 110.836 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -89.29 -1.41 58.06 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.499 0.925 . . . . 46.11 113.499 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 22.5 mtt-85 53.62 44.75 29.32 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.934 0.788 . . . . 42.76 111.785 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 87.3 mt -80.48 -11.1 59.72 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.761 0.652 . . . . 33.78 112.761 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -80.8 150.12 29.33 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.476 0.655 . . . . 37.98 110.644 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -71.47 133.06 45.61 Favored 'General case' 0 C--N 1.335 -0.059 0 CA-C-N 115.928 -0.578 . . . . 51.23 110.157 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -69.75 -26.83 64.5 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 118.711 -1.196 . . . . 83.03 112.142 -172.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -89.24 -45.87 9.21 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.653 0.612 . . . . 55.14 112.653 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -118.75 89.63 3.17 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 106.633 -1.618 . . . . 50.98 106.633 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -76.58 1.18 17.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.379 0.881 . . . . 32.61 113.379 -162.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -81.94 -7.1 59.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 118.643 -1.223 . . . . 44.87 112.507 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 62.8 mt -90.15 130.39 39.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.43 -0.952 . . . . 34.21 108.43 179.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 99.7 t -118.12 120.28 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 107.884 -1.154 . . . . 34.75 107.884 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -104.98 118.41 36.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.663 -0.866 . . . . 48.97 108.663 174.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 7.6 p -132.43 20.65 4.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.307 -0.406 . . . . 39.93 111.657 -167.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -63.17 -40.93 98.95 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.026 0.75 . . . . 59.4 113.026 -167.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -106.8 47.42 0.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 118.351 -1.34 . . . . 60.35 109.529 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -140.67 155.36 46.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.481 0.658 . . . . 35.9 109.532 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.0 tp -49.66 -37.12 27.16 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.662 -1.153 . . . . 58.5 112.106 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.4 tp -62.82 -36.64 83.85 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 122.101 -0.374 . . . . 39.73 111.885 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.56 -39.17 96.58 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.43 -0.891 . . . . 32.85 113.557 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -61.55 -43.52 98.71 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 117.376 0.588 . . . . 59.71 111.008 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.63 -44.54 93.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.334 -0.394 . . . . 46.14 111.033 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -88.66 -17.59 29.71 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 113.11 0.781 . . . . 65.38 113.11 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 70.21 30.28 69.68 Favored Glycine 0 CA--C 1.507 -0.423 0 C-N-CA 120.164 -1.017 . . . . 51.86 113.164 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 155.47 31.09 Favored Pre-proline 0 N--CA 1.45 -0.426 0 N-CA-C 107.567 -1.272 . . . . 45.77 107.567 -176.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.3 -15.55 11.32 Favored 'Trans proline' 0 C--O 1.239 0.528 0 N-CA-C 113.674 0.605 . . . . 41.19 113.674 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 67.8 p -163.51 160.35 23.1 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.839 -0.8 . . . . 47.83 108.839 -170.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -160.65 163.15 32.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.335 -0.987 . . . . 35.67 108.335 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.9 t -104.79 140.88 37.45 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.318 -0.856 . . . . 35.76 109.466 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -57.97 -20.04 13.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.953 -0.567 . . . . 34.18 110.939 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -70.78 -16.48 62.75 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 121.894 -0.504 . . . . 71.86 112.185 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -83.62 66.1 8.81 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.061 1.41 . . . . 43.76 110.772 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -50.63 -49.52 56.6 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 113.928 -1.487 . . . . 52.53 111.904 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.4 ttp-105 -62.82 -43.22 99.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 120.444 -0.503 . . . . 61.58 111.041 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.97 -39.87 94.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 121.015 -0.274 . . . . 53.25 111.723 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 85.2 mt -69.46 -44.88 79.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.043 -0.663 . . . . 31.37 110.789 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -61.16 -45.26 95.38 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.68 -0.808 . . . . 46.62 111.333 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.1 m -58.51 -46.96 85.68 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.931 -0.308 . . . . 46.12 111.654 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 20.1 mmt -62.67 -40.13 96.12 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.6 -0.84 . . . . 66.31 111.275 -179.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 94.3 mt -63.28 -47.02 94.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 118.845 -1.142 . . . . 36.87 110.606 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -63.35 -33.3 75.22 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 120.33 -0.548 . . . . 51.63 111.912 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -67.15 -12.29 59.6 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 118.847 -1.141 . . . . 41.48 112.567 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -117.56 23.77 11.53 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.211 0.819 . . . . 36.85 113.211 -175.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.3 pp -142.92 163.91 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.815 0.816 . . . . 34.77 109.76 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.4 t -111.38 126.52 68.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.068 -1.456 . . . . 42.12 107.068 170.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 41.3 t -76.79 135.76 26.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.107 -0.497 . . . . 56.49 109.94 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 71.7 t -94.38 95.07 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 106.682 -1.599 . . . . 59.22 106.682 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.708 ' OXT' ' O ' ' A' ' 201' ' ' HOH . 23.6 t30 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.312 0.577 . . . . 75.9 109.7 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.224 0.535 . . . . 92.35 112.24 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -77.5 130.22 36.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.715 -0.675 . . . . 68.97 110.077 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 50.8 mt -98.81 144.21 28.29 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.041 0.936 . . . . 41.66 111.453 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 33.8 m -123.8 154.68 30.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-O 122.092 0.949 . . . . 34.06 108.748 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -117.51 103.88 50.44 Favored Pre-proline 0 C--O 1.245 0.853 0 CA-C-N 115.16 -0.927 . . . . 35.74 109.694 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.408 ' HA ' HD23 ' B' ' 107' ' ' LEU . 62.7 Cg_exo -60.45 141.07 94.59 Favored 'Trans proline' 0 C--N 1.331 -0.351 0 C-N-CA 120.24 0.627 . . . . 33.86 111.607 177.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' B' ' 106' ' ' ASN . 67.9 mttm -69.29 164.23 50.75 Favored Pre-proline 0 N--CA 1.448 -0.565 0 CA-C-N 115.158 -0.928 . . . . 62.52 109.588 172.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -56.24 -42.52 65.26 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 115.967 1.487 . . . . 36.89 115.967 -167.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.32 -45.62 72.45 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 119.877 1.217 . . . . 55.16 111.57 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.404 HD13 HD21 ' B' ' 85' ' ' LEU . 46.5 tp -58.9 -40.34 84.18 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.414 -0.515 . . . . 30.86 110.977 176.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 33.8 tp -61.73 -40.74 96.16 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.247 -0.581 . . . . 36.67 111.147 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . . . -57.82 -43.69 85.91 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.054 0.39 . . . . 44.19 112.054 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 21.2 mt -62.45 -44.6 96.02 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.336 -0.545 . . . . 38.58 111.349 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' B' ' 56' ' ' TYR . 67.5 mt -64.02 -41.12 97.55 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.432 -0.907 . . . . 36.32 110.931 179.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -69.67 -21.63 63.51 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 118.726 -1.189 . . . . 46.16 112.261 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 53.5 p -66.88 -18.11 65.22 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 113.016 0.747 . . . . 34.83 113.016 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 17.9 m -112.2 22.91 5.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 119.214 0.916 . . . . 34.39 111.089 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.3 3.9 56.46 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 115.636 1.015 . . . . 33.1 115.636 168.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.64 148.04 49.98 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.996 -1.481 . . . . 39.46 108.214 172.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -120.3 -30.58 4.57 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.631 0.974 . . . . 54.03 113.631 -171.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -84.68 173.38 10.77 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.013 1.325 . . . . 58.04 110.334 -172.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -105.4 -17.11 14.55 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.652 0.982 . . . . 53.68 113.652 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 54.1 p -128.96 140.71 51.54 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.321 1.049 . . . . 36.21 109.012 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -141.05 165.22 28.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.668 0.746 . . . . 39.54 110.822 -170.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 58.6 p -76.94 158.87 30.4 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 116.307 -2.157 . . . . 39.69 108.728 160.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 13.4 tpt -57.4 -41.35 80.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 58.39 110.973 175.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . . . -58.74 -42.61 89.19 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.01 -0.676 . . . . 37.67 111.014 176.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -60.5 -48.87 79.87 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 122.088 -0.382 . . . . 59.25 111.794 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.1 m -60.81 -41.81 90.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 119.122 -1.031 . . . . 44.13 110.912 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.992 -0.683 . . . . 41.92 110.69 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -67.09 -43.98 81.17 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.106 -1.038 . . . . 38.0 110.934 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' TYR . . . . . 0.476 ' HB3' HD22 ' B' ' 38' ' ' LEU . 11.2 m-85 -61.78 -39.63 92.37 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.834 -0.746 . . . . 43.76 111.517 176.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.61 -42.78 86.3 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.186 -0.606 . . . . 35.79 111.801 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.16 98.86 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 119.499 -1.334 . . . . 26.71 111.764 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLN . . . . . 0.585 ' O ' HG23 ' B' ' 63' ' ' THR . 39.1 tt0 -58.76 -41.06 85.69 Favored 'General case' 0 C--O 1.24 0.591 0 O-C-N 122.297 -0.531 . . . . 30.54 111.11 176.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -59.64 -47.58 85.03 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.746 0.308 . . . . 32.62 111.297 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 58.4 mt -58.86 -37.67 68.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-O 121.064 0.459 . . . . 30.95 110.371 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' MET . . . . . . . . . . . . . 37.2 mtm -72.0 -40.62 68.39 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.99 -0.684 . . . . 33.82 111.714 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' THR . . . . . 0.585 HG23 ' O ' ' B' ' 59' ' ' GLN . 29.9 p -62.98 -35.49 80.36 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.645 -0.822 . . . . 40.22 112.034 179.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . 0.47 ' HE3' ' OD1' ' B' ' 80' ' ' ASP . 6.8 mmmt -87.76 0.18 56.1 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 121.485 -0.759 . . . . 63.07 112.432 176.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 49.68 46.38 23.83 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.575 0.702 . . . . 50.71 112.59 -179.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 71.3 mt -78.67 -10.24 59.68 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.888 0.699 . . . . 33.79 112.888 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -77.38 144.2 38.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.597 0.635 . . . . 34.95 110.604 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.99 138.82 54.85 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.073 -0.714 . . . . 54.13 109.073 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . . . -69.35 -32.07 70.9 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 119.134 -1.027 . . . . 50.71 112.79 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . . . -92.59 -42.97 9.37 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.311 0.856 . . . . 47.93 113.311 -177.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . . . -115.3 86.16 2.41 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 106.195 -1.779 . . . . 45.79 106.195 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -76.16 -1.28 25.47 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 113.92 1.082 . . . . 33.83 113.92 -163.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -78.91 -8.8 59.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 118.465 -1.294 . . . . 41.32 112.134 168.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 72.9 mt -92.83 131.15 40.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.626 -0.879 . . . . 51.24 108.626 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 93.7 t -116.08 124.64 72.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 123.904 0.882 . . . . 36.34 108.698 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -103.29 116.22 32.03 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.82 -0.807 . . . . 68.03 108.82 173.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.57 15.89 5.96 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.923 0.712 . . . . 42.71 112.923 -171.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 28.0 p -66.59 -26.08 66.93 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 119.538 -0.865 . . . . 57.92 110.997 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 47.3 p-10 -97.49 23.7 7.39 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.452 0.538 . . . . 51.37 112.452 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.47 ' OD1' ' HE3' ' B' ' 64' ' ' LYS . 10.8 t70 -138.97 151.52 46.93 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.236 -0.653 . . . . 42.49 109.236 -176.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 21.8 mt -51.55 -30.02 19.09 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.428 -0.805 . . . . 55.76 112.253 171.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.04 -35.92 74.12 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.873 -0.731 . . . . 40.75 111.509 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.05 -40.21 96.87 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.257 -0.973 . . . . 42.81 112.739 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -61.09 -43.05 99.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.624 -0.831 . . . . 70.39 110.115 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 34' ' ' LEU . 13.6 tp -59.58 -49.77 76.5 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.958 0.409 . . . . 62.86 111.89 179.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -87.13 -15.52 38.18 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.276 0.843 . . . . 46.61 113.276 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . 74.26 31.19 59.64 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 115.983 1.153 . . . . 53.4 115.983 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -154.07 152.11 25.94 Favored Pre-proline 0 C--O 1.234 0.285 0 CA-C-N 118.116 0.958 . . . . 52.64 108.968 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -80.13 -15.04 11.81 Favored 'Trans proline' 0 C--O 1.242 0.72 0 O-C-N 122.087 0.519 . . . . 42.77 113.205 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 73.8 p -164.4 160.88 21.19 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.447 -0.946 . . . . 46.53 108.447 -175.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 55.7 p90 -160.79 161.53 32.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.939 -0.763 . . . . 42.44 108.939 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 42.0 t -105.15 134.26 48.54 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.74 -0.664 . . . . 39.14 109.588 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 91.2 t -60.45 -21.06 22.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.92 -0.582 . . . . 44.03 110.982 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -70.42 -18.91 63.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.5 -0.88 . . . . 53.28 111.946 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -87.02 67.68 9.84 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.13 0.967 . . . . 71.56 108.75 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -54.53 -51.2 65.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.69 -1.141 . . . . 66.41 111.829 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . . . -60.17 -43.17 96.03 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 121.056 -0.258 . . . . 42.35 111.659 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . . . -64.1 -36.9 85.53 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.704 -0.398 . . . . 41.62 111.234 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ILE . . . . . . . . . . . . . 89.6 mt -68.05 -42.79 85.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 118.734 -1.186 . . . . 42.31 110.071 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -59.45 -42.91 93.04 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.922 -0.311 . . . . 43.58 111.367 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.9 m -58.02 -45.81 86.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.654 -0.418 . . . . 36.08 110.902 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' MET . . . . . . . . . . . . . 66.0 mtm -64.65 -40.66 95.83 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 119.527 -0.869 . . . . 48.56 110.963 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 97.6 mt -62.52 -43.2 98.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 120.535 -0.466 . . . . 34.4 110.901 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.46 -27.71 69.47 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.245 -0.582 . . . . 43.2 111.925 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.523 ' HD2' ' O ' ' B' ' 201' ' ' HOH . 97.0 mtt180 -66.81 -13.31 61.38 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.451 -0.5 . . . . 68.63 112.006 173.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' B' ' 31' ' ' LYS . 65.2 m-80 -117.48 18.18 14.37 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 118.072 0.396 . . . . 40.25 111.741 -176.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 30' ' ' PRO . 66.9 mt -139.03 152.67 47.79 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 123.368 0.667 . . . . 51.66 109.272 -179.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 90.1 t -122.24 132.85 70.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.431 -0.952 . . . . 43.46 108.431 169.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 41.1 t -72.88 135.59 27.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 108.973 -0.751 . . . . 41.55 108.973 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 45.1 t -88.49 -52.12 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.281 -0.418 . . . . 50.75 112.034 -176.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 27.0 p30 . . . . . 0 C--N 1.327 -0.41 0 O-C-N 121.97 -0.456 . . . . 87.14 110.682 -177.391 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.342 0.591 . . . . 47.31 109.606 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' SER . . . . . . . . . . . . . 88.3 p -73.11 157.25 37.63 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 122.045 0.926 . . . . 32.28 111.472 -175.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -53.06 -40.1 63.76 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.111 -0.95 . . . . 31.29 110.967 167.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.98 -40.29 80.29 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 119.833 -0.747 . . . . 28.96 111.307 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -72.15 -38.93 69.08 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.305 -0.558 . . . . 46.03 111.441 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -62.07 -42.63 99.4 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 119.635 -0.826 . . . . 46.43 110.651 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' TRP . . . . . . . . . . . . . 65.6 t-105 . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 109.424 -0.584 . . . . 39.11 109.424 -174.775 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 44.7 m . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.15 0.5 . . . . 53.37 111.034 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -72.46 156.45 39.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.129 -0.941 . . . . 32.06 110.978 -176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -53.51 -41.72 66.62 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.058 -0.974 . . . . 31.33 111.004 168.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.32 80.26 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.382 -0.527 . . . . 26.96 111.337 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -70.37 -38.58 74.78 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.429 -0.508 . . . . 57.04 111.337 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -62.45 -43.45 98.78 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.514 -0.874 . . . . 45.48 111.364 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 . . . . . 0 N--CA 1.438 -1.041 0 O-C-N 122.376 -0.203 . . . . 37.85 110.902 -173.825 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' G2B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' UCV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.708 ' O ' ' OXT' ' A' ' 111' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.513 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.523 ' O ' ' HD2' ' B' ' 105' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_